4-(4-methylphenyl)-5-oxidanylidene-2-(phenylmethylsulfanyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile

Systemtic Name: 4-(4-methylphenyl)-5-oxidanylidene-2-(phenylmethylsulfanyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile Openeye Name: 2-benzylsulfanyl-5-oxo-4-(p-tolyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile CAS Name: 4-(4-methylphenyl)-5-oxo-2-(phenylmethylthio)-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile IUPAC Name: 2-benzylsulfanyl-4-(4-methylphenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile Traditional Name: 2-(benzylthio)-5-keto-4-(p-tolyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile Formula: C24H22N2OS MolecularWeight: 386.50928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(=C(NC3=C2C(=O)CCC3)SCC4=CC=CC=C4)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2C(=C(NC3=C2C(=O)CCC3)SCC4=CC=CC=C4)C#N

InChI

InChI=1S/C24H22N2OS/c1-16-10-12-18(13-11-16)22-19(14-25)24(28-15-17-6-3-2-4-7-17)26-20-8-5-9-21(27)23(20)22/h2-4,6-7,10-13,22,26H,5,8-9,15H2,1H3