[2-[[4-[(4-methoxyphenyl)carbamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: [2-[[4-[(4-methoxyphenyl)carbamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 2-methylsulfanylpyridine-3-carboxylate Openeye Name: [2-[4-[(4-methoxyphenyl)carbamoyl]anilino]-2-oxo-ethyl] 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid [2-[4-[(4-methoxyanilino)-oxomethyl]anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-[(4-methoxyphenyl)carbamoyl]anilino]-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid [2-keto-2-[4-[(4-methoxyphenyl)carbamoyl]anilino]ethyl] ester Formula: C23H21N3O5S MolecularWeight: 451.49494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)COC(=O)C3=C(N=CC=C3)SC

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)COC(=O)C3=C(N=CC=C3)SC

InChI

InChI=1S/C23H21N3O5S/c1-30-18-11-9-17(10-12-18)26-21(28)15-5-7-16(8-6-15)25-20(27)14-31-23(29)19-4-3-13-24-22(19)32-2/h3-13H,14H2,1-2H3,(H,25,27)(H,26,28)