2-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxidanylidene-propyl]sulfanyl-4-(4-methylphenyl)-6-phenyl-pyridine-3-carbonitrile

Systemtic Name: 2-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxidanylidene-propyl]sulfanyl-4-(4-methylphenyl)-6-phenyl-pyridine-3-carbonitrile Openeye Name: 2-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxo-propyl]sulfanyl-6-phenyl-4-(p-tolyl)pyridine-3-carbonitrile CAS Name: 2-[[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]thio]-4-(4-methylphenyl)-6-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]sulfanyl-4-(4-methylphenyl)-6-phenylpyridine-3-carbonitrile Traditional Name: 2-[[3-(3,4-dihydro-2H-quinolin-1-yl)-3-keto-propyl]thio]-6-phenyl-4-(p-tolyl)nicotinonitrile Formula: C31H27N3OS MolecularWeight: 489.63058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)N3CCCC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)N3CCCC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C31H27N3OS/c1-22-13-15-23(16-14-22)26-20-28(24-8-3-2-4-9-24)33-31(27(26)21-32)36-19-17-30(35)34-18-7-11-25-10-5-6-12-29(25)34/h2-6,8-10,12-16,20H,7,11,17-19H2,1H3