methyl 4-[2-[5-methoxy-2-[(4-methylphenyl)sulfanylmethyl]-4-oxidanylidene-pyridin-1-yl]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[5-methoxy-2-[(4-methylphenyl)sulfanylmethyl]-4-oxidanylidene-pyridin-1-yl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[5-methoxy-4-oxo-2-(p-tolylsulfanylmethyl)-1-pyridyl]acetyl]amino]benzoate CAS Name: 4-[[2-[5-methoxy-2-[[(4-methylphenyl)thio]methyl]-4-oxo-1-pyridinyl]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[5-methoxy-2-[(4-methylphenyl)sulfanylmethyl]-4-oxopyridin-1-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[4-keto-5-methoxy-2-[(p-tolylthio)methyl]-1-pyridyl]acetyl]amino]benzoic acid methyl ester Formula: C24H24N2O5S MolecularWeight: 452.52276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=CC(=O)C(=CN2CC(=O)NC3=CC=C(C=C3)C(=O)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=CC(=O)C(=CN2CC(=O)NC3=CC=C(C=C3)C(=O)OC)OC

InChI

InChI=1S/C24H24N2O5S/c1-16-4-10-20(11-5-16)32-15-19-12-21(27)22(30-2)13-26(19)14-23(28)25-18-8-6-17(7-9-18)24(29)31-3/h4-13H,14-15H2,1-3H3,(H,25,28)