5-ethanoyl-4-(4-methoxyphenyl)-6-methyl-2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-pyridine-3-carbonitrile

Systemtic Name: 5-ethanoyl-4-(4-methoxyphenyl)-6-methyl-2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-pyridine-3-carbonitrile Openeye Name: 5-acetyl-4-(4-methoxyphenyl)-6-methyl-2-[2-oxo-2-(p-tolyl)ethyl]sulfanyl-pyridine-3-carbonitrile CAS Name: 5-acetyl-4-(4-methoxyphenyl)-6-methyl-2-[[2-(4-methylphenyl)-2-oxoethyl]thio]-3-pyridinecarbonitrile IUPAC Name: 5-acetyl-4-(4-methoxyphenyl)-6-methyl-2-[2-(4-methylphenyl)-2-oxoethyl]sulfanylpyridine-3-carbonitrile Traditional Name: 5-acetyl-2-[[2-keto-2-(p-tolyl)ethyl]thio]-4-(4-methoxyphenyl)-6-methyl-nicotinonitrile Formula: C25H22N2O3S MolecularWeight: 430.51878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NC(=C(C(=C2C#N)C3=CC=C(C=C3)OC)C(=O)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NC(=C(C(=C2C#N)C3=CC=C(C=C3)OC)C(=O)C)C

InChI

InChI=1S/C25H22N2O3S/c1-15-5-7-18(8-6-15)22(29)14-31-25-21(13-26)24(23(17(3)28)16(2)27-25)19-9-11-20(30-4)12-10-19/h5-12H,14H2,1-4H3