2-azanyl-4-[2,5-dimethyl-3-[(4-methylphenyl)sulfanylmethyl]phenyl]-7,7-dimethyl-1-naphthalen-1-yl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-[2,5-dimethyl-3-[(4-methylphenyl)sulfanylmethyl]phenyl]-7,7-dimethyl-1-naphthalen-1-yl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-4-[2,5-dimethyl-3-(p-tolylsulfanylmethyl)phenyl]-7,7-dimethyl-1-(1-naphthyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-4-[2,5-dimethyl-3-[[(4-methylphenyl)thio]methyl]phenyl]-7,7-dimethyl-1-(1-naphthalenyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-4-[2,5-dimethyl-3-[(4-methylphenyl)sulfanylmethyl]phenyl]-7,7-dimethyl-1-naphthalen-1-yl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-4-[2,5-dimethyl-3-[(p-tolylthio)methyl]phenyl]-5-keto-7,7-dimethyl-1-(1-naphthyl)-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C38H37N3OS MolecularWeight: 583.78488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=C(C(=CC(=C2)C)C3C(=C(N(C4=C3C(=O)CC(C4)(C)C)C5=CC=CC6=CC=CC=C65)N)C#N)C

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=C(C(=CC(=C2)C)C3C(=C(N(C4=C3C(=O)CC(C4)(C)C)C5=CC=CC6=CC=CC=C65)N)C#N)C

InChI

InChI=1S/C38H37N3OS/c1-23-13-15-28(16-14-23)43-22-27-17-24(2)18-30(25(27)3)35-31(21-39)37(40)41(33-19-38(4,5)20-34(42)36(33)35)32-12-8-10-26-9-6-7-11-29(26)32/h6-18,35H,19-20,22,40H2,1-5H3