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

Systemtic Name: (4R)-4-(4-chlorophenyl)-5-oxidanylidene-2-(phenylmethylsulfanyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile Openeye Name: (4R)-2-benzylsulfanyl-4-(4-chlorophenyl)-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile CAS Name: (4R)-4-(4-chlorophenyl)-5-oxo-2-(phenylmethylthio)-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile IUPAC Name: (4R)-2-benzylsulfanyl-4-(4-chlorophenyl)-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile Traditional Name: (4R)-2-(benzylthio)-4-(4-chlorophenyl)-5-keto-4,6,7,8-tetrahydro-3H-quinoline-3-carbonitrile Formula: C23H19ClN2OS MolecularWeight: 406.92776

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(C(=N2)SCC3=CC=CC=C3)C#N)C4=CC=C(C=C4)Cl)C(=O)C1

Isomeric SMILES

C1CC2=C([C@H](C(C(=N2)SCC3=CC=CC=C3)C#N)C4=CC=C(C=C4)Cl)C(=O)C1

InChI

InChI=1S/C23H19ClN2OS/c24-17-11-9-16(10-12-17)21-18(13-25)23(28-14-15-5-2-1-3-6-15)26-19-7-4-8-20(27)22(19)21/h1-3,5-6,9-12,18,21H,4,7-8,14H2/t18?,21-/m0/s1