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Benzothiazepiner

Aromatiske organiske heterocykliske forbindelser, der består af benzen fusioneret med en thiazepinring; thiazepiner er substituerede thiepiner, hvor et nitrogen erstatter et kulstof i den syvleddede heterocykliske forbindelse.

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1

N,N-Didesmethyl Diltiazem Hydrochloride, TRC

CAS: 116050-35-2 Molekylær formel: C20H23ClN2O4S Molekylvægt (g/mol): 422.93 Synonym: (2S-cis)-3-(Acetyloxy)-5-(2-aminoethyl)-2,3-dihydro-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one Monohydrochloride,(2S,3S)-N,N-Didemethyldiltiazem Hydrochloride SMIL: CC(=O)O[C@@H]1[C@@H](SC2=CC=CC=C2N(C1=O)CCN)C3=CC=C(C=C3)OC.Cl

Molekylvægt (g/mol) 422.93
CAS 116050-35-2
Synonym (2S-cis)-3-(Acetyloxy)-5-(2-aminoethyl)-2,3-dihydro-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one Monohydrochloride,(2S,3S)-N,N-Didemethyldiltiazem Hydrochloride
SMIL CC(=O)O[C@@H]1[C@@H](SC2=CC=CC=C2N(C1=O)CCN)C3=CC=C(C=C3)OC.Cl
Molekylær formel C20H23ClN2O4S
2

N-Desmethyl Diltiazem Hydrochloride, TRC

CAS: 130606-60-9 Molekylær formel: C21 H24 N2 O4 S . Cl H Molekylvægt (g/mol): 436.95 Synonym: (2S,3S)-2-(4-Methoxyphenyl)-5-[2-(methylamino)ethyl]-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl Acetate Hydrochloride,Diltiazem Hydrochloride Imp. D (EP) as Hydrochloride,N-Desmethyl-diltiazem Hydrochloride IUPAC navn: [(2S,3S)-2-(4-methoxyphenyl)-5-[2-(methylamino)ethyl]-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate;hydrochloride SMIL: Cl.CNCCN1C(=O)[C@H](OC(=O)C)[C@@H](Sc2ccccc12)c3ccc(OC)cc3

Molekylvægt (g/mol) 436.95
CAS 130606-60-9
Synonym (2S,3S)-2-(4-Methoxyphenyl)-5-[2-(methylamino)ethyl]-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl Acetate Hydrochloride,Diltiazem Hydrochloride Imp. D (EP) as Hydrochloride,N-Desmethyl-diltiazem Hydrochloride
SMIL Cl.CNCCN1C(=O)[C@H](OC(=O)C)[C@@H](Sc2ccccc12)c3ccc(OC)cc3
IUPAC navn [(2S,3S)-2-(4-methoxyphenyl)-5-[2-(methylamino)ethyl]-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate;hydrochloride
Molekylær formel C21 H24 N2 O4 S . Cl H
3

N-Des[2-(2-hydroxyethoxy)ethyl] Quetiapine Dihydrochloride, TRC

CAS: 111974-74-4 Molekylær formel: C17 H17 N3 S . 2 Cl H Molekylvægt (g/mol): 368.32 Synonym: 11-(Piperazin-1-yl)dibenzo[b,f][1,4]thiazepine Dihydrochloride,Quetiapine Fumarate Imp. B (EP) as Dihydrochloride,Dibenzo[b,f][1,4]thiazepine, 11-(1-piperazinyl)-, hydrochloride (1:2),Dibenzo[b,f][1,4]thiazepine, 11-(1-piperazinyl)-, dihydrochloride (9CI),11-(1-Piperazinyl)-dibenzo[b,f][1,4]thiazepine dihydrochloride,11-Piperazin-1-yl-dibenzo[b,f][1,4]thiazepine dihydrochloride,11-Piperazinodibenzo[b,f][1,4]thiazepine dihydrochloride,Norquetiapine dihydrochloride,N-Des[2-(2-hydroxyethoxy)ethyl]quetiapine dihydrochloride IUPAC navn: 6-piperazin-1-ylbenzo[b][1,4]benzothiazepine;dihydrochloride SMIL: Cl.Cl.C1CN(CCN1)C2=Nc3ccccc3Sc4ccccc24

Molekylvægt (g/mol) 368.32
CAS 111974-74-4
Synonym 11-(Piperazin-1-yl)dibenzo[b,f][1,4]thiazepine Dihydrochloride,Quetiapine Fumarate Imp. B (EP) as Dihydrochloride,Dibenzo[b,f][1,4]thiazepine, 11-(1-piperazinyl)-, hydrochloride (1:2),Dibenzo[b,f][1,4]thiazepine, 11-(1-piperazinyl)-, dihydrochloride (9CI),11-(1-Piperazinyl)-dibenzo[b,f][1,4]thiazepine dihydrochloride,11-Piperazin-1-yl-dibenzo[b,f][1,4]thiazepine dihydrochloride,11-Piperazinodibenzo[b,f][1,4]thiazepine dihydrochloride,Norquetiapine dihydrochloride,N-Des[2-(2-hydroxyethoxy)ethyl]quetiapine dihydrochloride
SMIL Cl.Cl.C1CN(CCN1)C2=Nc3ccccc3Sc4ccccc24
IUPAC navn 6-piperazin-1-ylbenzo[b][1,4]benzothiazepine;dihydrochloride
Molekylær formel C17 H17 N3 S . 2 Cl H
6
Kampagner er tilgængelige

Thermo Scientific Chemicals Diltiazem hydrochlorid, 98%

CAS: 33286-22-5 Molekylær formel: C22H26N2O4S·HCl Molekylvægt (g/mol): 450.99 MDL nummer: MFCD00069252 InChI nøgle: HDRXZJPWHTXQRI-BHDTVMLSSA-N Synonym: diltiazem hydrochloride,diltiazem hcl,herbesser,dilzene,lacerol,masdil,tildiem,tiazac,mono-tildiem,bi-tildiem PubChem CID: 62920 ChEBI: CHEBI:645509 IUPAC navn: [(2S,3S)-5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl]acetat;hydrochlorid SMIL: CC(=O)OC1C(SC2=CC=CC=C2N(C1=O)CCN(C)C)C3=CC=C(C=C3)OC.Cl

MDL nummer MFCD00069252
PubChem CID 62920
Molekylvægt (g/mol) 450.99
CAS 33286-22-5
ChEBI CHEBI:645509
Synonym diltiazem hydrochloride,diltiazem hcl,herbesser,dilzene,lacerol,masdil,tildiem,tiazac,mono-tildiem,bi-tildiem
SMIL CC(=O)OC1C(SC2=CC=CC=C2N(C1=O)CCN(C)C)C3=CC=C(C=C3)OC.Cl
IUPAC navn [(2S,3S)-5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl]acetat;hydrochlorid
InChI nøgle HDRXZJPWHTXQRI-BHDTVMLSSA-N
Molekylær formel C22H26N2O4S·HCl
7

3,5-dihydro-2H-1,5-benzothiazepin-4-one, TRC

CAS: 53454-43-6 Molekylær formel: C9H9NOS Molekylvægt (g/mol): 179.24 Synonym: 2,3,4,5-Tetrahydro-1,5-benzothiazepin-4-one IUPAC navn: 3,5-dihydro-2H-1,5-benzothiazepin-4-one SMIL: O=C1CCSc2ccccc2N1

Molekylvægt (g/mol) 179.24
CAS 53454-43-6
Synonym 2,3,4,5-Tetrahydro-1,5-benzothiazepin-4-one
SMIL O=C1CCSc2ccccc2N1
IUPAC navn 3,5-dihydro-2H-1,5-benzothiazepin-4-one
Molekylær formel C9H9NOS
8

(4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl)eddikesyre, 97 %, Thermo Scientific™

CAS: 17547-79-4 Molekylær formel: C11H11NO3S Molekylvægt (g/mol): 237.27 MDL nummer: MFCD01416244 InChI nøgle: VCSCQLDBPVHQPW-UHFFFAOYNA-N Synonym: 4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetic acid,benzo b perhydrothiazepin-4-one-3-acetic acid,4-oxo-3,5-dihydro-2h-1,5-benzothiazepin-3-yl acetic acid,1,5-benzothiazepine-3-aceticacid, 2,3,4,5-tetrahydro-4-oxo,2-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetic acid,2-4-oxo-2h,3h,5h-benzo b 1,4-thiazepin-3-yl acetic acid,2-4-oxo-3,5-dihydro-2h-1,5-benzothiazepin-3-yl acetic acid,4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-3-acetic acid,4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetic acid #,1,5-benzothiazepine-3-acetic acid, 2,3,4,5-tetrahydro-4-oxo PubChem CID: 580528 IUPAC navn: 2-(4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)eddikesyre SMIL: OC(=O)CC1CSC2=CC=CC=C2NC1=O

MDL nummer MFCD01416244
PubChem CID 580528
Molekylvægt (g/mol) 237.27
CAS 17547-79-4
Synonym 4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetic acid,benzo b perhydrothiazepin-4-one-3-acetic acid,4-oxo-3,5-dihydro-2h-1,5-benzothiazepin-3-yl acetic acid,1,5-benzothiazepine-3-aceticacid, 2,3,4,5-tetrahydro-4-oxo,2-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetic acid,2-4-oxo-2h,3h,5h-benzo b 1,4-thiazepin-3-yl acetic acid,2-4-oxo-3,5-dihydro-2h-1,5-benzothiazepin-3-yl acetic acid,4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-3-acetic acid,4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetic acid #,1,5-benzothiazepine-3-acetic acid, 2,3,4,5-tetrahydro-4-oxo
SMIL OC(=O)CC1CSC2=CC=CC=C2NC1=O
IUPAC navn 2-(4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)eddikesyre
InChI nøgle VCSCQLDBPVHQPW-UHFFFAOYNA-N
Molekylær formel C11H11NO3S