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Diazanaphthalenes

Organic heterocyclic compounds that consist of a naphthalene double ring in which two of the carbon atoms have been replaced with nitrogen atoms.
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1

Endofenazin A, TRC

CAS: 86125-71-5 Molekylær formel: C18H16N2O2 Molekylvægt (g/mol): 292.33 Synonym: 9-(3-Methyl-2-buten-1-yl)-1-phenazinecarboxylic Acid,9-(3-Methyl-2-butenyl)-1-phenazinecarboxylic Acid IUPAC navn: 9-(3-methylbut-2-enyl)phenazine-1-carboxylic acid SMIL: CC(=CCc1cccc2nc3cccc(C(=O)O)c3nc12)C

Molekylvægt (g/mol) 292.33
CAS 86125-71-5
Synonym 9-(3-Methyl-2-buten-1-yl)-1-phenazinecarboxylic Acid,9-(3-Methyl-2-butenyl)-1-phenazinecarboxylic Acid
SMIL CC(=CCc1cccc2nc3cccc(C(=O)O)c3nc12)C
IUPAC navn 9-(3-methylbut-2-enyl)phenazine-1-carboxylic acid
Molekylær formel C18H16N2O2
2

Fenquinotrione, TRC

CAS: 1342891-70-6 Molekylær formel: C22 H17 Cl N2 O5 Molekylvægt (g/mol): 424.8338 Synonym: 1,3-Cyclohexanedione, 2-[[8-chloro-3,4-dihydro-4-(4-methoxyphenyl)-3-oxo-2-quinoxalinyl]carbonyl]-,Fenquinotrione IUPAC navn: 2-[8-chloro-4-(4-methoxyphenyl)-3-oxoquinoxaline-2-carbonyl]cyclohexane-1,3-dione SMIL: COc1ccc(cc1)N2C(=O)C(=Nc3c(Cl)cccc23)C(=O)C4C(=O)CCCC4=O

Molekylvægt (g/mol) 424.8338
CAS 1342891-70-6
Synonym 1,3-Cyclohexanedione, 2-[[8-chloro-3,4-dihydro-4-(4-methoxyphenyl)-3-oxo-2-quinoxalinyl]carbonyl]-,Fenquinotrione
SMIL COc1ccc(cc1)N2C(=O)C(=Nc3c(Cl)cccc23)C(=O)C4C(=O)CCCC4=O
IUPAC navn 2-[8-chloro-4-(4-methoxyphenyl)-3-oxoquinoxaline-2-carbonyl]cyclohexane-1,3-dione
Molekylær formel C22 H17 Cl N2 O5
3

6-Cyano-7-nitroquinoxalin-2,3-dione, TRC

CAS: 115066-14-3 Molekylær formel: C9 H4 N4 O4 Molekylvægt (g/mol): 232.15 IUPAC navn: 7-nitro-2,3-dioxo-1,4-dihydroquinoxaline-6-carbonitrile SMIL: [O-][N+](=O)c1cc2NC(=O)C(=O)Nc2cc1C#N

Molekylvægt (g/mol) 232.15
CAS 115066-14-3
SMIL [O-][N+](=O)c1cc2NC(=O)C(=O)Nc2cc1C#N
IUPAC navn 7-nitro-2,3-dioxo-1,4-dihydroquinoxaline-6-carbonitrile
Molekylær formel C9 H4 N4 O4
4

6-Nitro-4-quinazolon, TRC

CAS: 6943-17-5 Molekylær formel: C8H5N3O3 Molekylvægt (g/mol): 191.14 Synonym: 6-Nitro-3H-quinazolin-4-one,6-Nitro-4(1H)-quinazolinone,6-Nitroquinazolin-4-ol,6-Nitro-3,4-dihydroquinazolin-4-one,NSC 51669 IUPAC navn: 6-nitro-1H-quinazolin-4-one SMIL: [O-][N+](=O)c1ccc2NC=NC(=O)c2c1

Molekylvægt (g/mol) 191.14
CAS 6943-17-5
Synonym 6-Nitro-3H-quinazolin-4-one,6-Nitro-4(1H)-quinazolinone,6-Nitroquinazolin-4-ol,6-Nitro-3,4-dihydroquinazolin-4-one,NSC 51669
SMIL [O-][N+](=O)c1ccc2NC=NC(=O)c2c1
IUPAC navn 6-nitro-1H-quinazolin-4-one
Molekylær formel C8H5N3O3
5

Poziotinib, TRC

CAS: 1092364-38-9 Molekylær formel: C23H21Cl2FN4O3 Molekylvægt (g/mol): 491.34 Synonym: 1-[4-[[4-[(3,4-Dichloro-2-fluorophenyl)amino]-7-methoxy-6-quinazolinyl]oxy]-1-piperidinyl]-2-propen-1-one,1-[4-[4-(3,4-Dichloro-2-fluoroanilino)-7-methoxyquinazolin-6-yl]oxypiperidin-1-yl]prop-2-en-1-one IUPAC navn: 1-[4-[4-(3,4-dichloro-2-fluoroanilino)-7-methoxyquinazolin-6-yl]oxypiperidin-1-yl]prop-2-en-1-one SMIL: COc1cc2ncnc(Nc3ccc(Cl)c(Cl)c3F)c2cc1OC4CCN(CC4)C(=O)C=C

Molekylvægt (g/mol) 491.34
CAS 1092364-38-9
Synonym 1-[4-[[4-[(3,4-Dichloro-2-fluorophenyl)amino]-7-methoxy-6-quinazolinyl]oxy]-1-piperidinyl]-2-propen-1-one,1-[4-[4-(3,4-Dichloro-2-fluoroanilino)-7-methoxyquinazolin-6-yl]oxypiperidin-1-yl]prop-2-en-1-one
SMIL COc1cc2ncnc(Nc3ccc(Cl)c(Cl)c3F)c2cc1OC4CCN(CC4)C(=O)C=C
IUPAC navn 1-[4-[4-(3,4-dichloro-2-fluoroanilino)-7-methoxyquinazolin-6-yl]oxypiperidin-1-yl]prop-2-en-1-one
Molekylær formel C23H21Cl2FN4O3
6

Lapatinib Ditosylatmonohydrat, TRC

CAS: 388082-78-8 Molekylær formel: C29 H26 Cl F N4 O4 S . 2 C7 H8 O3 S . H2 O Molekylvægt (g/mol): 943.48 Synonym: 4-Quinazolinamine, N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[[[2-(methylsulfonyl)ethyl]amino]methyl]-2-furanyl]-, 4-methylbenzenesulfonate, hydrate (1:2:1),4-Quinazolinamine, N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[[[2-(methylsulfonyl)ethyl]amino]methyl]-2-furanyl]-, bis(4-methylbenzenesulfonate), monohydrate (9CI),Lapatinib ditosylate monohydrate,GW 572016F,GW 572016F IUPAC navn: N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[(2-methylsulfonylethylamino)methyl]furan-2-yl]quinazolin-4-amine;4-methylbenzenesulfonic acid;hydrate SMIL: O.Cc1ccc(cc1)S(=O)(=O)O.Cc2ccc(cc2)S(=O)(=O)O.CS(=O)(=O)CCNCc3oc(cc3)c4ccc5ncnc(Nc6ccc(OCc7cccc(F)c7)c(Cl)c6)c5c4

Molekylvægt (g/mol) 943.48
CAS 388082-78-8
Synonym 4-Quinazolinamine, N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[[[2-(methylsulfonyl)ethyl]amino]methyl]-2-furanyl]-, 4-methylbenzenesulfonate, hydrate (1:2:1),4-Quinazolinamine, N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[[[2-(methylsulfonyl)ethyl]amino]methyl]-2-furanyl]-, bis(4-methylbenzenesulfonate), monohydrate (9CI),Lapatinib ditosylate monohydrate,GW 572016F,GW 572016F
SMIL O.Cc1ccc(cc1)S(=O)(=O)O.Cc2ccc(cc2)S(=O)(=O)O.CS(=O)(=O)CCNCc3oc(cc3)c4ccc5ncnc(Nc6ccc(OCc7cccc(F)c7)c(Cl)c6)c5c4
IUPAC navn N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[(2-methylsulfonylethylamino)methyl]furan-2-yl]quinazolin-4-amine;4-methylbenzenesulfonic acid;hydrate
Molekylær formel C29 H26 Cl F N4 O4 S . 2 C7 H8 O3 S . H2 O
7

CGS-12066A maleatsalt, TRC

CAS: 1350965-83-1 Molekylær formel: C17H17F3N4 . C4H4O4 Molekylvægt (g/mol): 450.4 Synonym: CGS-12066A Maleate Salt,4-(4-Methyl-1-piperazinyl)-7-(trifluoromethyl)-pyrrolo[1,2-a]quinoxaline (2Z)-2-Butenedioate IUPAC navn: (Z)-but-2-enedioic acid;4-(4-methylpiperazin-1-yl)-7-(trifluoromethyl)pyrrolo[1,2-a]quinoxaline SMIL: CN1CCN(CC1)c2nc3cc(ccc3n4cccc24)C(F)(F)F.OC(=O)\C=C/C(=O)O

Molekylvægt (g/mol) 450.4
CAS 1350965-83-1
Synonym CGS-12066A Maleate Salt,4-(4-Methyl-1-piperazinyl)-7-(trifluoromethyl)-pyrrolo[1,2-a]quinoxaline (2Z)-2-Butenedioate
SMIL CN1CCN(CC1)c2nc3cc(ccc3n4cccc24)C(F)(F)F.OC(=O)\C=C/C(=O)O
IUPAC navn (Z)-but-2-enedioic acid;4-(4-methylpiperazin-1-yl)-7-(trifluoromethyl)pyrrolo[1,2-a]quinoxaline
Molekylær formel C17H17F3N4 . C4H4O4
8

Dacomitinib, TRC

CAS: 1110813-31-4 Molekylær formel: C24 H25 Cl F N5 O2 Molekylvægt (g/mol): 469.94 IUPAC navn: (E)-N-[4-(3-chloro-4-fluoroanilino)-7-methoxyquinazolin-6-yl]-4-piperidin-1-ylbut-2-enamide SMIL: COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\CN4CCCCC4

Molekylvægt (g/mol) 469.94
CAS 1110813-31-4
SMIL COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\CN4CCCCC4
IUPAC navn (E)-N-[4-(3-chloro-4-fluoroanilino)-7-methoxyquinazolin-6-yl]-4-piperidin-1-ylbut-2-enamide
Molekylær formel C24 H25 Cl F N5 O2
10

N-De[2-(methylsulfonyl)ethyl] Lapatinib, TRC

CAS: 697299-82-4 Molekylær formel: C26H20ClFN4O2 Molekylvægt (g/mol): 474.91 Synonym: 6-[5-(Aminomethyl)-2-furanyl]-N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-4-quinazolinamine,[6-(5-Aminomethylfuran-2-yl)quinazolin-4-yl][3-chloro- 4-(3-fluorobenzyloxy)phenyl]amine SMIL: Cc1nc2c3c(ccc2nc1)n(C)c(N)n3

Molekylvægt (g/mol) 474.91
CAS 697299-82-4
Synonym 6-[5-(Aminomethyl)-2-furanyl]-N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-4-quinazolinamine,[6-(5-Aminomethylfuran-2-yl)quinazolin-4-yl][3-chloro- 4-(3-fluorobenzyloxy)phenyl]amine
SMIL Cc1nc2c3c(ccc2nc1)n(C)c(N)n3
Molekylær formel C26H20ClFN4O2
11

rac-Pagoclone, TRC

CAS: 133737-48-1 Molekylær formel: C23H22ClN3O2 Molekylvægt (g/mol): 407.89 Synonym: 2-(7-Chloro-1,8-naphthyridin-2-yl)-2,3-dihydro-3-(5-methyl-2-oxohexyl)-1H-isoindol-1-one,RP 59037,IP 456,RP 62955 SMIL: CC(C)CCC(=O)CC1C2=CC=CC=C2C(=O)N1C3=NC4=C(C=CC(=N4)Cl)C=C3

Molekylvægt (g/mol) 407.89
CAS 133737-48-1
Synonym 2-(7-Chloro-1,8-naphthyridin-2-yl)-2,3-dihydro-3-(5-methyl-2-oxohexyl)-1H-isoindol-1-one,RP 59037,IP 456,RP 62955
SMIL CC(C)CCC(=O)CC1C2=CC=CC=C2C(=O)N1C3=NC4=C(C=CC(=N4)Cl)C=C3
Molekylær formel C23H22ClN3O2
12

Bunazosin Hydrochloride, TRC

High-purity organic molecules and analytical standards, strategically delivered worldwide to empower innovation and commercial success.

13

N2-Methyl Alfuzosin, TRC

CAS: 72104-34-8 Molekylær formel: C19 H27 N5 O4 . Cl H Molekylvægt (g/mol): 425.91 Synonym: Alfuzosin Hydrochloride Imp. C (EP) as Hydrochloride,(2RS)-N-[3-[(4-amino-6,7-dimethoxyquinazolin-2-yl)amino]propyl]-N-methyltetrahydrofuran-2-carboxamide Hydrochloride IUPAC navn: N-[3-[(4-amino-6,7-dimethoxyquinazolin-2-yl)amino]propyl]-N-methyloxolane-2-carboxamid; hydrochlorid SMIL: Cl.COc1cc2nc(NCCCN(C)C(=O)C3CCCO3)nc(N)c2cc1OC

Molekylvægt (g/mol) 425.91
CAS 72104-34-8
Synonym Alfuzosin Hydrochloride Imp. C (EP) as Hydrochloride,(2RS)-N-[3-[(4-amino-6,7-dimethoxyquinazolin-2-yl)amino]propyl]-N-methyltetrahydrofuran-2-carboxamide Hydrochloride
SMIL Cl.COc1cc2nc(NCCCN(C)C(=O)C3CCCO3)nc(N)c2cc1OC
IUPAC navn N-[3-[(4-amino-6,7-dimethoxyquinazolin-2-yl)amino]propyl]-N-methyloxolane-2-carboxamid; hydrochlorid
Molekylær formel C19 H27 N5 O4 . Cl H
14

Alfuzosin Hydrochlorid, TRC

CAS: 81403-68-1 Molekylær formel: C19 H27 N5 O4 . Cl H Molekylvægt (g/mol): 425.91 Synonym: Alfuzosin hydrochloride,(2RS)-N-[3-[(4-Amino-6,7-dimethoxyquinazolin-2-yl)methylamino]propyl]tetrahydrofuran-2-carboxamide hydrochloride,SL 77-499-10,SL 77499-10,Urion,Uroxatral,Xatral,Alfoten IUPAC navn: N-[3-[(4-amino-6,7-dimethoxyquinazolin-2-yl)-methylamino]propyl]oxolin-2-carboxamid; hydrochlorid SMIL: Cl.COc1cc2nc(nc(N)c2cc1OC)N(C)CCCNC(=O)C3CCCO3

Molekylvægt (g/mol) 425.91
CAS 81403-68-1
Synonym Alfuzosin hydrochloride,(2RS)-N-[3-[(4-Amino-6,7-dimethoxyquinazolin-2-yl)methylamino]propyl]tetrahydrofuran-2-carboxamide hydrochloride,SL 77-499-10,SL 77499-10,Urion,Uroxatral,Xatral,Alfoten
SMIL Cl.COc1cc2nc(nc(N)c2cc1OC)N(C)CCCNC(=O)C3CCCO3
IUPAC navn N-[3-[(4-amino-6,7-dimethoxyquinazolin-2-yl)-methylamino]propyl]oxolin-2-carboxamid; hydrochlorid
Molekylær formel C19 H27 N5 O4 . Cl H
15

Fenquizone, TRC

CAS: 20287-37-0 Molekylær formel: C14 H12 Cl N3 O3 S Molekylvægt (g/mol): 337.78 Synonym: 7-Chloro-1,2,3,4-tetrahydro-4-oxo-2-phenyl-6-quinazolinesulfonamide; IUPAC navn: 1-(3-Bromo-4-fluorophenyl) propan-1-one SMIL: NS(=O)(=O)c1cc2C(=O)NC(Nc2cc1Cl)c3ccccc3

Molekylvægt (g/mol) 337.78
CAS 20287-37-0
Synonym 7-Chloro-1,2,3,4-tetrahydro-4-oxo-2-phenyl-6-quinazolinesulfonamide;
SMIL NS(=O)(=O)c1cc2C(=O)NC(Nc2cc1Cl)c3ccccc3
IUPAC navn 1-(3-Bromo-4-fluorophenyl) propan-1-one
Molekylær formel C14 H12 Cl N3 O3 S