Diazanaphthalenes
Phenazine Ethosulfate, TRC
CAS: 10510-77-7 Molecular Formula: C14H13N2 .C2H5O4S Molecular Weight (g/mol): 334.4 Synonym: N-Ethylphenazinium Ethyl Sulfate,N-Ethylphenazonium Ethyl Sulfate,NSC 402863 IUPAC Name: (E)-3-(2,5-dimethylanilino)-1-phenylprop-2-en-1-one SMILES: Cc1ccc(C)c(N\C=C\C(=O)c2ccccc2)c1
1-Chlorophthalazine, TRC
CAS: 5784-45-2 Molecular Formula: C8 H5 Cl N2 Molecular Weight (g/mol): 164.59 Synonym: Phthalazine, 1-chloro-,1-Chlorophthalazine,NSC 71104 IUPAC Name: 1-chlorophthalazine SMILES: Clc1nncc2ccccc12
Fenquizone, TRC
CAS: 20287-37-0 Molecular Formula: C14 H12 Cl N3 O3 S Molecular Weight (g/mol): 337.78 Synonym: 7-Chloro-1,2,3,4-tetrahydro-4-oxo-2-phenyl-6-quinazolinesulfonamide; IUPAC Name: 1-(3-Bromo-4-fluorophenyl)propan-1-one SMILES: NS(=O)(=O)c1cc2C(=O)NC(Nc2cc1Cl)c3ccccc3
Metolazone, TRC
CAS: 17560-51-9 Molecular Formula: C16 H16 Cl N3 O3 S Molecular Weight (g/mol): 365.83 Synonym: Metolazone,(2RS)-7-Chloro-2-methyl-3-(2-methylphenyl)-4-oxo-1,2,3,4-tetrahydroquinazoline-6-sulfonamide,6-Quinazolinesulfonamide, 7-chloro-1,2,3,4-tetrahydro-2-methyl-3-(2-methylphenyl)-4-oxo- (9CI, ACI),6-Quinazolinesulfonamide, 7-chloro-1,2,3,4-tetrahydro-2-methyl-4-oxo-3-o-tolyl- (8CI),7-Chloro-1,2,3,4-tetrahydro-2-methyl-3-(2-methylphenyl)-4-oxo-6-quinazolinesulfonamide (ACI),2-Methyl-3-(o-tolyl)-6-sulfamyl-7-chloro-1,2,3,4-tetrahydro-4-quinazolinone,7-Chloro-2-methyl-3-(2-methylphenyl)-4-oxo-1,2-dihydroquinazoline-6-sulfonamide,Diulo,MeSH ID: D008788,Metazoline,Metenix,Metozalone,Mykrox,Normelan,Oldren,SR 720-22,Xuret,Zaroxolyn IUPAC Name: 7-chloro-2-methyl-3-(2-methylphenyl)-4-oxo-1,2-dihydroquinazoline-6-sulfonamide SMILES: CC1Nc2cc(Cl)c(cc2C(=O)N1c3ccccc3C)S(=O)(=O)N
2-Amino-3,7,8-trimethyl-3H-imidazo[4,5-f]quinoxaline, TRC
CAS: 92180-79-5 Molecular Formula: C12 H13 N5 Molecular Weight (g/mol): 227.27 Synonym: 3,7,8-Trimethyl-3H-imidazo[4,5-f]quinoxalin-2-amine,2-Amino-3,7,8-trimethylimidazo[4,5-f]quinoxaline,7,8-DiMeIQx IUPAC Name: 3,7,8-trimethylimidazo[4,5-f]quinoxalin-2-amine SMILES: Cc1nc2ccc3c(nc(N)n3C)c2nc1C
3-Deschloro-4-desfluoro-4-chloro-3-fluoro Gefitinib, TRC
CAS: 1603814-04-5 Molecular Formula: C22 H24 Cl F N4 O3 Molecular Weight (g/mol): 446.9 Synonym: 4-Quinazolinamine, N-(4-chloro-3-fluorophenyl)-7-methoxy-6-[3-(4-morpholinyl)propoxy]-,Gefitinib Imp. B (EP),N-(4-Chloro-3-fluorophenyl)-7-methoxy-6-[3-(4-morpholinyl)propoxy]-4-quinazolinamine,N-(4-Chloro-3-fluorophenyl)-7-methoxy-6-[3-(morpholin-4-yl)propoxy]quinazolin-4-amine,3-Deschloro-4-desfluoro-4-chloro-3-fluoro Gefitinib IUPAC Name: N-(4-chloro-3-fluorophenyl)-7-methoxy-6-(3-morpholin-4-ylpropoxy)quinazolin-4-amine SMILES: COc1cc2ncnc(Nc3ccc(Cl)c(F)c3)c2cc1OCCCN4CCOCC4
6-Nitro-4-quinazolone, TRC
CAS: 6943-17-5 Molecular Formula: C8H5N3O3 Molecular Weight (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 Name: 6-nitro-1H-quinazolin-4-one SMILES: [O-][N+](=O)c1ccc2NC=NC(=O)c2c1
O-Desmorpholinopropyl-O-methyl-gefitinib, TRC
CAS: 153437-78-6 Molecular Formula: C16H13ClFN3O2 Molecular Weight (g/mol): 333.74 Synonym: 4-Quinazolinamine, N-(3-chloro-4-fluorophenyl)-6,7-dimethoxy-,N-(3-Chloro-4-fluorophenyl)-6,7-dimethoxy-4-quinazolinamine,N-(3-Chloro-4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine IUPAC Name: N-(3-chloro-4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine SMILES: COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OC
3-Methylquinoxaline-2-carboxylic Acid, TRC
CAS: 74003-63-7 Molecular Formula: C10 H8 N2 O2 Molecular Weight (g/mol): 188.18 Synonym: 2-Quinoxalinecarboxylic acid, 3-methyl- (7CI, 9CI, ACI),3-Methyl-2-quinoxalinecarboxylic acid (ACI),MQCA IUPAC Name: 3-methylquinoxaline-2-carboxylic acid SMILES: Cc1nc2ccccc2nc1C(=O)O
Fenquinotrione, TRC
CAS: 1342891-70-6 Molecular Formula: C22 H17 Cl N2 O5 Molecular Weight (g/mol): 424.8338 Synonym: 1,3-Cyclohexanedione, 2-[[8-chloro-3,4-dihydro-4-(4-methoxyphenyl)-3-oxo-2-quinoxalinyl]carbonyl]-,Fenquinotrione IUPAC Name: 2-[8-chloro-4-(4-methoxyphenyl)-3-oxoquinoxaline-2-carbonyl]cyclohexane-1,3-dione SMILES: COc1ccc(cc1)N2C(=O)C(=Nc3c(Cl)cccc23)C(=O)C4C(=O)CCCC4=O
Sulfaquinoxaline, TRC
CAS: 59-40-5 Molecular Formula: C14 H12 N4 O2 S Molecular Weight (g/mol): 300.34 Synonym: 4-Amino-N-2-quinoxalinyl-benzenesulfonamide,Sulfanilamide, N1-2-quinoxalinyl- (6CI,7CI,8CI),2-(p-Sulfanilamido)quinoxaline,2-Sulfanilamidobenzopyrazine,2-p-Aminobenzenesulfonamidoquinoxaline,2-p-Aminobenzenesulphonamidoquinoxaline,Avicocid,Compound 3-120,Italquina,Kokozigal,N1-(2-Quinoxalinyl)sulfanilamide,NSC 41805,SQ 40,SQX,Sulfa-Q 20,Sulfabenzpyrazine,Sulfaline,Sulfaquinoxaline,Sulphaquinoxaline,Sulquin,Ursokoxaline,Sulfachinoxalin IUPAC Name: 4-amino-N-quinoxalin-2-ylbenzenesulfonamide SMILES: Nc1ccc(cc1)S(=O)(=O)Nc2cnc3ccccc3n2
Lapatinib Ditosylate Monohydrate, TRC
CAS: 388082-78-8 Molecular Formula: C29 H26 Cl F N4 O4 S . 2 C7 H8 O3 S . H2 O Molecular Weight (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 Name: N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[(2-methylsulfonylethylamino)methyl]furan-2-yl]quinazolin-4-amine;4-methylbenzenesulfonic acid;hydrate SMILES: 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
2-Amino-3-methyl-3H-imidazo[4,5-f]quinoxaline, TRC
CAS: 108354-47-8 Molecular Formula: C10 H9 N5 Molecular Weight (g/mol): 199.21 Synonym: 3-Methyl-3H-imidazo[4,5-f]quinoxalin-2-amine,3-Methyl-3H-imidazo[4,5-f]quinoxalin-2-amine,2-Amino-3-Methylimidazo[4,5-f]quinoxaline,3-Methylimidazo[4,5-f]quinoxalin-2-amine IUPAC Name: 3-methylimidazo[4,5-f]quinoxalin-2-amine SMILES: Cn1c(N)nc2c3nccnc3ccc12