5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-phenyl-pyridine-3-carboxamide

Systemtic Name: 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-phenyl-pyridine-3-carboxamide Openeye Name: 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-[2-(2-methylanilino)-2-oxo-ethyl]sulfanyl-N-phenyl-pyridine-3-carboxamide CAS Name: 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-[[2-(2-methylanilino)-2-oxoethyl]thio]-N-phenyl-3-pyridinecarboxamide IUPAC Name: 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-[2-(2-methylanilino)-2-oxoethyl]sulfanyl-N-phenylpyridine-3-carboxamide Traditional Name: 5-cyano-4-(3,4-dimethoxyphenyl)-6-[[2-keto-2-(o-toluidino)ethyl]thio]-2-methyl-N-phenyl-nicotinamide Formula: C31H28N4O4S MolecularWeight: 552.64342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CSC2=NC(=C(C(=C2C#N)C3=CC(=C(C=C3)OC)OC)C(=O)NC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CSC2=NC(=C(C(=C2C#N)C3=CC(=C(C=C3)OC)OC)C(=O)NC4=CC=CC=C4)C

InChI

InChI=1S/C31H28N4O4S/c1-19-10-8-9-13-24(19)35-27(36)18-40-31-23(17-32)29(21-14-15-25(38-3)26(16-21)39-4)28(20(2)33-31)30(37)34-22-11-6-5-7-12-22/h5-16H,18H2,1-4H3,(H,34,37)(H,35,36)