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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)C3CC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)C3CC3)C4=CC=CC=C4

InChI

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