ethyl 5-cyano-6-[2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-6-[2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[2-(2-methoxy-5-methyl-anilino)-2-oxo-1-phenyl-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-6-[[2-(2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl]thio]-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[2-(2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl]sulfanyl-2-methylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-keto-2-(2-methoxy-5-methyl-anilino)-1-phenyl-ethyl]thio]-2-methyl-nicotinic acid ethyl ester Formula: C26H25N3O4S MolecularWeight: 475.5594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SC(C2=CC=CC=C2)C(=O)NC3=C(C=CC(=C3)C)OC)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SC(C2=CC=CC=C2)C(=O)NC3=C(C=CC(=C3)C)OC)C

InChI

InChI=1S/C26H25N3O4S/c1-5-33-26(31)20-14-19(15-27)25(28-17(20)3)34-23(18-9-7-6-8-10-18)24(30)29-21-13-16(2)11-12-22(21)32-4/h6-14,23H,5H2,1-4H3,(H,29,30)