6-cyclopropyl-2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 6-cyclopropyl-2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-pyridine-3-carbonitrile Openeye Name: 6-cyclopropyl-2-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-4-phenyl-pyridine-3-carbonitrile CAS Name: 6-cyclopropyl-2-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 6-cyclopropyl-2-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4-phenylpyridine-3-carbonitrile Traditional Name: 6-cyclopropyl-2-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-4-phenyl-nicotinonitrile Formula: C24H20N2O2S MolecularWeight: 400.4928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CSC2=C(C(=CC(=N2)C3CC3)C4=CC=CC=C4)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CSC2=C(C(=CC(=N2)C3CC3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C24H20N2O2S/c1-28-19-11-9-18(10-12-19)23(27)15-29-24-21(14-25)20(16-5-3-2-4-6-16)13-22(26-24)17-7-8-17/h2-6,9-13,17H,7-8,15H2,1H3