2-(2-oxidanylidenecyclohexyl)sulfanyl-4-phenyl-7-(phenylmethylidene)-5,6-dihydrocyclopenta[b]pyridine-3-carbonitrile

Systemtic Name: 2-(2-oxidanylidenecyclohexyl)sulfanyl-4-phenyl-7-(phenylmethylidene)-5,6-dihydrocyclopenta[b]pyridine-3-carbonitrile Openeye Name: 7-benzylidene-2-(2-oxocyclohexyl)sulfanyl-4-phenyl-5,6-dihydrocyclopenta[b]pyridine-3-carbonitrile CAS Name: 2-[(2-oxocyclohexyl)thio]-4-phenyl-7-(phenylmethylene)-5,6-dihydrocyclopenta[b]pyridine-3-carbonitrile IUPAC Name: 7-benzylidene-2-(2-oxocyclohexyl)sulfanyl-4-phenyl-5,6-dihydrocyclopenta[b]pyridine-3-carbonitrile Traditional Name: 7-benzal-2-[(2-ketocyclohexyl)thio]-4-phenyl-1-pyrindan-3-carbonitrile Formula: C28H24N2OS MolecularWeight: 436.56796

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)SC2=NC3=C(CCC3=CC4=CC=CC=C4)C(=C2C#N)C5=CC=CC=C5

Isomeric SMILES

C1CCC(=O)C(C1)SC2=NC3=C(CCC3=CC4=CC=CC=C4)C(=C2C#N)C5=CC=CC=C5

InChI

InChI=1S/C28H24N2OS/c29-18-23-26(20-11-5-2-6-12-20)22-16-15-21(17-19-9-3-1-4-10-19)27(22)30-28(23)32-25-14-8-7-13-24(25)31/h1-6,9-12,17,25H,7-8,13-16H2