ethyl 2-azanyl-1-(4-chlorophenyl)-7,7-dimethyl-4-(4-methylsulfanylphenyl)-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carboxylate

Systemtic Name: ethyl 2-azanyl-1-(4-chlorophenyl)-7,7-dimethyl-4-(4-methylsulfanylphenyl)-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carboxylate Openeye Name: ethyl 2-amino-1-(4-chlorophenyl)-7,7-dimethyl-4-(4-methylsulfanylphenyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carboxylate CAS Name: 2-amino-1-(4-chlorophenyl)-7,7-dimethyl-4-[4-(methylthio)phenyl]-5-oxo-6,8-dihydro-4H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-1-(4-chlorophenyl)-7,7-dimethyl-4-(4-methylsulfanylphenyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carboxylate Traditional Name: 2-amino-1-(4-chlorophenyl)-5-keto-7,7-dimethyl-4-[4-(methylthio)phenyl]-6,8-dihydro-4H-quinoline-3-carboxylic acid ethyl ester Formula: C27H29ClN2O3S MolecularWeight: 497.04876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C(C1C3=CC=C(C=C3)SC)C(=O)CC(C2)(C)C)C4=CC=C(C=C4)Cl)N

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C(C1C3=CC=C(C=C3)SC)C(=O)CC(C2)(C)C)C4=CC=C(C=C4)Cl)N

InChI

InChI=1S/C27H29ClN2O3S/c1-5-33-26(32)24-22(16-6-12-19(34-4)13-7-16)23-20(14-27(2,3)15-21(23)31)30(25(24)29)18-10-8-17(28)9-11-18/h6-13,22H,5,14-15,29H2,1-4H3