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Benzazepines

Organic heterocyclic compounds consisting of a benzene ring fused to an azepine ring; azepine rings are seven-membered rings with six carbon atoms and one nitrogen atom.
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1

rac trans-10,11-Dihydro-10,11-dihydroxy Carbamazepin, TRC

CAS: 58955-93-4 Molekylær formel: C15 H14 N2 O3 Molekylvægt (g/mol): 270.28 Synonym: 5H-Dibenz[b,f]azepine-5-carboxamide, 10,11-dihydro-10,11-dihydroxy-, (10R,11R)-rel-,5H-Dibenz[b,f]azepine-5-carboxamide, 10,11-dihydro-10,11-dihydroxy-, trans-,rel-(10R,11R)-10,11-Dihydro-10,11-dihydroxy-5H-dibenz[b,f]azepine-5-carboxamide,CGP 10000,Carbamazepine-10,11-dihydro-10,11-dihydroxy,Dihydrocarbamazepine-10,11-trans-diol,trans-10,11-Dihydro-10,11-dihydroxycarbamazepine,trans-10,11-Dihydroxy-10,11-dihydrocarbamazepine,trans-Carbamazepine-10,11-dihydro-10,11-dihydroxide IUPAC navn: (5R,6R)-5,6-dihydroxy-5,6-dihydrobenzo[b][1]benzazepin-11-carboxamid SMIL: NC(=O)N1c2ccccc2[C@@H](O)[C@H](O)c3ccccc13

Molekylvægt (g/mol) 270.28
CAS 58955-93-4
Synonym 5H-Dibenz[b,f]azepine-5-carboxamide, 10,11-dihydro-10,11-dihydroxy-, (10R,11R)-rel-,5H-Dibenz[b,f]azepine-5-carboxamide, 10,11-dihydro-10,11-dihydroxy-, trans-,rel-(10R,11R)-10,11-Dihydro-10,11-dihydroxy-5H-dibenz[b,f]azepine-5-carboxamide,CGP 10000,Carbamazepine-10,11-dihydro-10,11-dihydroxy,Dihydrocarbamazepine-10,11-trans-diol,trans-10,11-Dihydro-10,11-dihydroxycarbamazepine,trans-10,11-Dihydroxy-10,11-dihydrocarbamazepine,trans-Carbamazepine-10,11-dihydro-10,11-dihydroxide
SMIL NC(=O)N1c2ccccc2[C@@H](O)[C@H](O)c3ccccc13
IUPAC navn (5R,6R)-5,6-dihydroxy-5,6-dihydrobenzo[b][1]benzazepin-11-carboxamid
Molekylær formel C15 H14 N2 O3
2

10,11-Dihydro-5H-dibenzo[b,f]azepin, TRC

CAS: 494-19-9 Molekylær formel: C14 H13 N Molekylvægt (g/mol): 195.26 Synonym: Iminodibenzyl,10,11-Dihydro-5H-dibenzo[b,f]azepine,Clomipramine Hydrochloride Imp. E (EP),Trimipramine Maleate Imp. F (EP),Carbamazepine Imp. E (EP) IUPAC navn: 6,11-dihydro-5H-benzo[b][1]benzazepin SMIL: C1Cc2ccccc2Nc3ccccc13

Molekylvægt (g/mol) 195.26
CAS 494-19-9
Synonym Iminodibenzyl,10,11-Dihydro-5H-dibenzo[b,f]azepine,Clomipramine Hydrochloride Imp. E (EP),Trimipramine Maleate Imp. F (EP),Carbamazepine Imp. E (EP)
SMIL C1Cc2ccccc2Nc3ccccc13
IUPAC navn 6,11-dihydro-5H-benzo[b][1]benzazepin
Molekylær formel C14 H13 N
3

Zilpaterol, TRC

CAS: 119520-05-7 Molekylær formel: C14 H19 N3 O2 Molekylvægt (g/mol): 261.32 Synonym: Imidazo[4,5,1-jk][1]benzazepin-2(1H)-one, 4,5,6,7-tetrahydro-7-hydroxy-6-[(1-methylethyl)amino]-, (6R,7R)-rel-Imidazo[4,5,1-jk][1]benzazepin-2(1H)-one, 4,5,6,7-tetrahydro-7-hydroxy-6-[(1-methylethyl)amino]-, trans-(±)-,RU 42173,Zilpaterol,trans-(±)-Zilpaterol SMIL: CC(C)N[C@@H]1CCN2C(=O)Nc3cccc([C@H]1O)c23

Molekylvægt (g/mol) 261.32
CAS 119520-05-7
Synonym Imidazo[4,5,1-jk][1]benzazepin-2(1H)-one, 4,5,6,7-tetrahydro-7-hydroxy-6-[(1-methylethyl)amino]-, (6R,7R)-rel-Imidazo[4,5,1-jk][1]benzazepin-2(1H)-one, 4,5,6,7-tetrahydro-7-hydroxy-6-[(1-methylethyl)amino]-, trans-(±)-,RU 42173,Zilpaterol,trans-(±)-Zilpaterol
SMIL CC(C)N[C@@H]1CCN2C(=O)Nc3cccc([C@H]1O)c23
Molekylær formel C14 H19 N3 O2
4

10,11-Dihydro Carbamazepin, TRC

CAS: 3564-73-6 Molekylær formel: C15 H14 N2 O Molekylvægt (g/mol): 238.28 Synonym: 10,11-Dihydro-5H-dibenzo[b,f]-azepine-5-carboxamide,Carbamazepine Imp. A (EP),10,11-Dihydro-carbamazepine,Carbamazepine-10,11-dihydro IUPAC navn: 5,6-dihydrobenzo[b][1]benzazepin-11-carboxamid SMIL: NC(=O)N1c2ccccc2CCc3ccccc13

Molekylvægt (g/mol) 238.28
CAS 3564-73-6
Synonym 10,11-Dihydro-5H-dibenzo[b,f]-azepine-5-carboxamide,Carbamazepine Imp. A (EP),10,11-Dihydro-carbamazepine,Carbamazepine-10,11-dihydro
SMIL NC(=O)N1c2ccccc2CCc3ccccc13
IUPAC navn 5,6-dihydrobenzo[b][1]benzazepin-11-carboxamid
Molekylær formel C15 H14 N2 O
5

3-klor-5-(3-chlorpropyl)-10,11-dihydro-5H-dibenz[b,f]azepin (>90%), TRC

CAS: 51551-41-8 Molekylær formel: C17 H17 Cl2 N Molekylvægt (g/mol): 306.23 IUPAC navn: 2-klor-11-(3-klorpropyl)-5,6-dihydrobenzo[b][1]benzazepin SMIL: ClCCCN1c2ccccc2CCc3ccc(Cl)cc13

Molekylvægt (g/mol) 306.23
CAS 51551-41-8
SMIL ClCCCN1c2ccccc2CCc3ccc(Cl)cc13
IUPAC navn 2-klor-11-(3-klorpropyl)-5,6-dihydrobenzo[b][1]benzazepin
Molekylær formel C17 H17 Cl2 N
6

Imipramin N-oxid hydrat, TRC

CAS: 1215681-42-7 Molekylær formel: C19H24N2O • x(H2O) Molekylvægt (g/mol): 296.411802 Synonym: 10,11-Dihydro-N,N-dimethyl-5H-dibenz[b,f]azepine-5-propanamine N-Oxide Hydrate,5-[3-(Dimethylamino)propyl]-10,11-dihydro-5H-dibenz[b,f]azepine 5-oxide Hydrate,Imipraminoxide Hydrate IUPAC navn: 3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-aminoxid; Hydrate SMIL: CN(CCCN1C2=C(C=CC=C2)CCC3=C1C=CC=C3)(C)=O

Molekylvægt (g/mol) 296.411802
CAS 1215681-42-7
Synonym 10,11-Dihydro-N,N-dimethyl-5H-dibenz[b,f]azepine-5-propanamine N-Oxide Hydrate,5-[3-(Dimethylamino)propyl]-10,11-dihydro-5H-dibenz[b,f]azepine 5-oxide Hydrate,Imipraminoxide Hydrate
SMIL CN(CCCN1C2=C(C=CC=C2)CCC3=C1C=CC=C3)(C)=O
IUPAC navn 3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-aminoxid; Hydrate
Molekylær formel C19H24N2O • x(H2O)
7

Desipramin-d3, TRC

CAS: 65100-49-4 Molekylær formel: C18 2H3 H20 N3 Molekylvægt (g/mol): 284.41 Synonym: Desipramine D3 IUPAC navn: N,N-dimethyl-3-(2,3,4-trideuterio-5,6-dihydrobenzo[b][1,4]benzodiazepin-11-yl)propan-1-amin SMIL: [2H]c1cc2N(CCCN(C)C)c3ccccc3CNc2c([2H])c1[2H]

Molekylvægt (g/mol) 284.41
CAS 65100-49-4
Synonym Desipramine D3
SMIL [2H]c1cc2N(CCCN(C)C)c3ccccc3CNc2c([2H])c1[2H]
IUPAC navn N,N-dimethyl-3-(2,3,4-trideuterio-5,6-dihydrobenzo[b][1,4]benzodiazepin-11-yl)propan-1-amin
Molekylær formel C18 2H3 H20 N3
8

4-Methoxy-2-nitroanilin (2-Nitro-p-anisidin), TRC

CAS: 96-96-8 Molekylær formel: C7 H8 N2 O3 Molekylvægt (g/mol): 168.15 Synonym: Benzenamine, 4-methoxy-2-nitro-,4-Methoxy-2-nitroaniline IUPAC navn: 4-methoxy-2-nitroanilin SMIL: COc1ccc(N)c(c1)[N+](=O)[O-]

Molekylvægt (g/mol) 168.15
CAS 96-96-8
Synonym Benzenamine, 4-methoxy-2-nitro-,4-Methoxy-2-nitroaniline
SMIL COc1ccc(N)c(c1)[N+](=O)[O-]
IUPAC navn 4-methoxy-2-nitroanilin
Molekylær formel C7 H8 N2 O3
9

N-Demethyl Ivabradinhydrochlorid, TRC

Højrenheds organiske molekyler og analytiske standarder, strategisk leveret verden over for at muliggøre innovation og kommerciel succes.

Kemisk navn eller materiale N-Demethyl Ivabradine Hydrochloride
Anbefalet opbevaring +4 °C
Molekylvægt (g/mol) 491.02
InChI formel InChI=1S/C26H34N2O5.ClH/c1-30-22-11-17-6-9-28(26(29)14-18(17)12-23(22)31-2)8-5-7-27-16-20-10-19-13-24(32-3)25(33-4)15-21(19)20;/h11-13,15,20,27H,5-10,14,16H2,1-4H3;1H/t20-;/m1./s1
CAS 1246638-08-3
Formel vægt 490.2234
Synonym 2H-3-Benzazepin-2-one, 3-[3-[[[(7S)-3,4-dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl]methyl]amino]propyl]-1,3,4,5-tetrahydro-7,8-dimethoxy-, hydrobromide (1:1)
SMIL Cl.COc1cc2CCN(CCCNC[C@H]3Cc4cc(OC)c(OC)cc34)C(=O)Cc2cc1OC
IUPAC navn 3-[3-[[(7S)-3,4-dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one; hydrochlorid
Molekylær formel C26 H34 N2 O5 . Cl H
10

Desipramin Hydrochlorid, TRC

CAS: 58-28-6 Molekylær formel: C18 H22 N2 . Cl H Molekylvægt (g/mol): 302.84 Synonym: Desipramine Hydrochloride,3-(10,11-Dihydro-5H-dibenzo[b,f]azepin-5-yl)-N-methylpropan-1-amine Hydrochloride,Imipramine Hydrochloride Imp. A (EP) as Hydrochloride,5H-Dibenz[b,f]azepine-5-propanamine, 10,11-dihydro-N-methyl-, hydrochloride (1:1),5H-Dibenz[b,f]azepine, 10,11-dihydro-5-[3-(methylamino)propyl]-, monohydrochloride (8CI),5H-Dibenz[b,f]azepine-5-propanamine, 10,11-dihydro-N-methyl-, monohydrochloride (9CI),10,11-Dihydro-5-[3-(methylamino)propyl]-5H-dibenz[b,f]azepine monohydrochloride,5-[3-(Methylamino)propyl]-5H-dibenz[b,f]azepine hydrochloride,DMI hydrochloride,Demethylimipramine hydrochloride,Desimipramine-hydrochloride,Desipramine monohydrochloride,Desmethylimipramine chloride,Desmethylimipramine monohydrochloride,Desmethylimipramine-hydrochloride,EX 4355,G 35020,GMI,JB 8181,N-(γ-Methylaminopropyl)iminodibenzyl hydrochloride,NSC 114901,Norpramin,Nortrimil,Pertofran,Pertofrane,RMI 9384A IUPAC navn: 3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N-methylpropan-1-amin; hydrochlorid SMIL: Cl.CNCCCN1c2ccccc2CCc3ccccc13

Molekylvægt (g/mol) 302.84
CAS 58-28-6
Synonym Desipramine Hydrochloride,3-(10,11-Dihydro-5H-dibenzo[b,f]azepin-5-yl)-N-methylpropan-1-amine Hydrochloride,Imipramine Hydrochloride Imp. A (EP) as Hydrochloride,5H-Dibenz[b,f]azepine-5-propanamine, 10,11-dihydro-N-methyl-, hydrochloride (1:1),5H-Dibenz[b,f]azepine, 10,11-dihydro-5-[3-(methylamino)propyl]-, monohydrochloride (8CI),5H-Dibenz[b,f]azepine-5-propanamine, 10,11-dihydro-N-methyl-, monohydrochloride (9CI),10,11-Dihydro-5-[3-(methylamino)propyl]-5H-dibenz[b,f]azepine monohydrochloride,5-[3-(Methylamino)propyl]-5H-dibenz[b,f]azepine hydrochloride,DMI hydrochloride,Demethylimipramine hydrochloride,Desimipramine-hydrochloride,Desipramine monohydrochloride,Desmethylimipramine chloride,Desmethylimipramine monohydrochloride,Desmethylimipramine-hydrochloride,EX 4355,G 35020,GMI,JB 8181,N-(γ-Methylaminopropyl)iminodibenzyl hydrochloride,NSC 114901,Norpramin,Nortrimil,Pertofran,Pertofrane,RMI 9384A
SMIL Cl.CNCCCN1c2ccccc2CCc3ccccc13
IUPAC navn 3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N-methylpropan-1-amin; hydrochlorid
Molekylær formel C18 H22 N2 . Cl H
11

Lorcaserin Hydrochlorid (>50% ee), TRC

CAS: 846589-98-8 Molekylær formel: C11 H14 Cl N . Cl H Molekylvægt (g/mol): 232.15 Synonym: 1H-3-Benzazepine, 8-chloro-2,3,4,5-tetrahydro-1-methyl-, hydrochloride (1:1), (1R)-,1H-3-Benzazepine, 8-chloro-2,3,4,5-tetrahydro-1-methyl-, hydrochloride, (1R)- (9CI),(R)-8-Chloro-1-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine hydrochloride,(R)-8-Chloro-1-methyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine hydrochloride,APD 356,Lorcaserin hydrochloride IUPAC navn: (5R)-7-chloro-5-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine; hydrochlorid SMIL: Cl.C[C@H]1CNCCc2ccc(Cl)cc12

Molekylvægt (g/mol) 232.15
CAS 846589-98-8
Synonym 1H-3-Benzazepine, 8-chloro-2,3,4,5-tetrahydro-1-methyl-, hydrochloride (1:1), (1R)-,1H-3-Benzazepine, 8-chloro-2,3,4,5-tetrahydro-1-methyl-, hydrochloride, (1R)- (9CI),(R)-8-Chloro-1-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine hydrochloride,(R)-8-Chloro-1-methyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine hydrochloride,APD 356,Lorcaserin hydrochloride
SMIL Cl.C[C@H]1CNCCc2ccc(Cl)cc12
IUPAC navn (5R)-7-chloro-5-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine; hydrochlorid
Molekylær formel C11 H14 Cl N . Cl H
12

Epinastin hydrochlorid, TRC

CAS: 108929-04-0 Molekylær formel: C16 H15 N3 . Cl H Molekylvægt (g/mol): 285.77 Synonym: (13bRS)-9,13b-Dihydro-1H-dibenzo[c,f]imidazo[1,5-a]azepin-3-amine hydrochloride,1H-Dibenz[c,f]imidazo[1,5-a]azepin-3-amine, 9,13b-dihydro-, monohydrochloride (9CI),Alesion,Elestat,Epinastine hydrochloride,WAL 801CL IUPAC navn: (13bRS)-9,13b-Dihydro-1H-dibenzo[c,f]imidazo[1,5-a]azepin-3-amin hydrochlorid SMIL: Cl.NC1=NCC2N1c3ccccc3Cc4ccccc24

Molekylvægt (g/mol) 285.77
CAS 108929-04-0
Synonym (13bRS)-9,13b-Dihydro-1H-dibenzo[c,f]imidazo[1,5-a]azepin-3-amine hydrochloride,1H-Dibenz[c,f]imidazo[1,5-a]azepin-3-amine, 9,13b-dihydro-, monohydrochloride (9CI),Alesion,Elestat,Epinastine hydrochloride,WAL 801CL
SMIL Cl.NC1=NCC2N1c3ccccc3Cc4ccccc24
IUPAC navn (13bRS)-9,13b-Dihydro-1H-dibenzo[c,f]imidazo[1,5-a]azepin-3-amin hydrochlorid
Molekylær formel C16 H15 N3 . Cl H
13

10-Acetoxy-5H-dibenz[b,f]azepin-5-carboxamid, TRC

CAS: 952740-00-0 Molekylær formel: C17 H14 N2 O3 Molekylvægt (g/mol): 294.3 Synonym: 10-(Acetyloxy)-5H-dibenz[b,f]azepine-5-carboxamide IUPAC navn: 10-Acetoxy-5H-dibenz[b,f]azepin-5-carboxamid SMIL: CC(=O)OC1=Cc2ccccc2N(C(=O)N)c3ccccc13

Molekylvægt (g/mol) 294.3
CAS 952740-00-0
Synonym 10-(Acetyloxy)-5H-dibenz[b,f]azepine-5-carboxamide
SMIL CC(=O)OC1=Cc2ccccc2N(C(=O)N)c3ccccc13
IUPAC navn 10-Acetoxy-5H-dibenz[b,f]azepin-5-carboxamid
Molekylær formel C17 H14 N2 O3
14

N-desmethylklomipramin hydrochlorid, TRC

CAS: 29854-14-6 Molekylær formel: C18 H21 Cl N2 . Cl H Molekylvægt (g/mol): 337.29 Synonym: Desmethylclomipramine Hydrochloride IUPAC navn: 3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N-methylpropan-1-amin; hydrochlorid SMIL: Cl.CNCCCN1c2ccccc2CCc3ccc(Cl)cc13

Molekylvægt (g/mol) 337.29
CAS 29854-14-6
Synonym Desmethylclomipramine Hydrochloride
SMIL Cl.CNCCCN1c2ccccc2CCc3ccc(Cl)cc13
IUPAC navn 3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N-methylpropan-1-amin; hydrochlorid
Molekylær formel C18 H21 Cl N2 . Cl H
15

cis-10,11-dihydroxy-10,11-dihydrocarbamazepin, TRC

CAS: 58955-94-5 Molekylær formel: C15H14N2O3 Molekylvægt (g/mol): 270.28 Synonym: 5H-Dibenz[b,f]azepine-5-carboxamide, 10,11-dihydro-10,11-dihydroxy-, (10R,11S)-rel-,5H-Dibenz[b,f]azepine-5-carboxamide, 10,11-dihydro-10,11-dihydroxy-, cis-,rel-(10R,11S)-10,11-Dihydro-10,11-dihydroxy-5H-dibenz[b,f]azepine-5-carboxamide,CGP 5924,cis-10,11-Dihydro-10,11-dihydroxycarbamazepine,cis-10,11-Dihydroxy-10,11-dihydrocarbamazepine,cis-Carbamazepine-10,11-dihydro-10,11-dihydroxide IUPAC navn: (5S,6R)-5,6-dihydroxy-5,6-dihydrobenzo[b][1]benzazepin-11-carboxamid SMIL: NC(=O)N1c2ccccc2[C@H](O)[C@H](O)c3ccccc13

Molekylvægt (g/mol) 270.28
CAS 58955-94-5
Synonym 5H-Dibenz[b,f]azepine-5-carboxamide, 10,11-dihydro-10,11-dihydroxy-, (10R,11S)-rel-,5H-Dibenz[b,f]azepine-5-carboxamide, 10,11-dihydro-10,11-dihydroxy-, cis-,rel-(10R,11S)-10,11-Dihydro-10,11-dihydroxy-5H-dibenz[b,f]azepine-5-carboxamide,CGP 5924,cis-10,11-Dihydro-10,11-dihydroxycarbamazepine,cis-10,11-Dihydroxy-10,11-dihydrocarbamazepine,cis-Carbamazepine-10,11-dihydro-10,11-dihydroxide
SMIL NC(=O)N1c2ccccc2[C@H](O)[C@H](O)c3ccccc13
IUPAC navn (5S,6R)-5,6-dihydroxy-5,6-dihydrobenzo[b][1]benzazepin-11-carboxamid
Molekylær formel C15H14N2O3