2-azanyl-1-(3-chloranyl-2-methyl-phenyl)-7,7-dimethyl-3-(4-methylphenyl)carbonyl-4-(4-methylsulfanylphenyl)-6,8-dihydro-4H-quinolin-5-one

Systemtic Name: 2-azanyl-1-(3-chloranyl-2-methyl-phenyl)-7,7-dimethyl-3-(4-methylphenyl)carbonyl-4-(4-methylsulfanylphenyl)-6,8-dihydro-4H-quinolin-5-one Openeye Name: 2-amino-1-(3-chloro-2-methyl-phenyl)-7,7-dimethyl-3-(4-methylbenzoyl)-4-(4-methylsulfanylphenyl)-6,8-dihydro-4H-quinolin-5-one CAS Name: 2-amino-1-(3-chloro-2-methylphenyl)-7,7-dimethyl-3-[(4-methylphenyl)-oxomethyl]-4-[4-(methylthio)phenyl]-6,8-dihydro-4H-quinolin-5-one IUPAC Name: 2-amino-1-(3-chloro-2-methylphenyl)-7,7-dimethyl-3-(4-methylbenzoyl)-4-(4-methylsulfanylphenyl)-6,8-dihydro-4H-quinolin-5-one Traditional Name: 2-amino-1-(3-chloro-2-methyl-phenyl)-7,7-dimethyl-4-[4-(methylthio)phenyl]-3-p-toluoyl-6,8-dihydro-4H-quinolin-5-one Formula: C33H33ClN2O2S MolecularWeight: 557.14532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=C(N(C3=C(C2C4=CC=C(C=C4)SC)C(=O)CC(C3)(C)C)C5=C(C(=CC=C5)Cl)C)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=C(N(C3=C(C2C4=CC=C(C=C4)SC)C(=O)CC(C3)(C)C)C5=C(C(=CC=C5)Cl)C)N

InChI

InChI=1S/C33H33ClN2O2S/c1-19-9-11-22(12-10-19)31(38)30-28(21-13-15-23(39-5)16-14-21)29-26(17-33(3,4)18-27(29)37)36(32(30)35)25-8-6-7-24(34)20(25)2/h6-16,28H,17-18,35H2,1-5H3