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

Systemtic Name: 4-(4-chlorophenyl)-5-cyano-6-[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-2-methyl-N-phenyl-pyridine-3-carboxamide Openeye Name: 4-(4-chlorophenyl)-5-cyano-6-[2-(3,4-dimethylanilino)-2-oxo-ethyl]sulfanyl-2-methyl-N-phenyl-pyridine-3-carboxamide CAS Name: 4-(4-chlorophenyl)-5-cyano-6-[[2-(3,4-dimethylanilino)-2-oxoethyl]thio]-2-methyl-N-phenyl-3-pyridinecarboxamide IUPAC Name: 4-(4-chlorophenyl)-5-cyano-6-[2-(3,4-dimethylanilino)-2-oxoethyl]sulfanyl-2-methyl-N-phenylpyridine-3-carboxamide Traditional Name: 4-(4-chlorophenyl)-5-cyano-6-[[2-(3,4-dimethylanilino)-2-keto-ethyl]thio]-2-methyl-N-phenyl-nicotinamide Formula: C30H25ClN4O2S MolecularWeight: 541.0631

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NC(=C(C(=C2C#N)C3=CC=C(C=C3)Cl)C(=O)NC4=CC=CC=C4)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NC(=C(C(=C2C#N)C3=CC=C(C=C3)Cl)C(=O)NC4=CC=CC=C4)C)C

InChI

InChI=1S/C30H25ClN4O2S/c1-18-9-14-24(15-19(18)2)34-26(36)17-38-30-25(16-32)28(21-10-12-22(31)13-11-21)27(20(3)33-30)29(37)35-23-7-5-4-6-8-23/h4-15H,17H2,1-3H3,(H,34,36)(H,35,37)