6-methyl-2-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 6-methyl-2-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 6-methyl-2-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 6-methyl-2-[[2-oxo-2-(4-phenylphenyl)ethyl]thio]-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 6-methyl-2-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-[[2-keto-2-(4-phenylphenyl)ethyl]thio]-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C25H22N2OS MolecularWeight: 398.51998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(C(=N2)SCC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1CCC2=C(C1)C=C(C(=N2)SCC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C25H22N2OS/c1-17-7-12-23-21(13-17)14-22(15-26)25(27-23)29-16-24(28)20-10-8-19(9-11-20)18-5-3-2-4-6-18/h2-6,8-11,14,17H,7,12-13,16H2,1H3