[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 2-[1-methyl-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylpyridine-3-carboxylate

Systemtic Name: [2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 2-[1-methyl-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylpyridine-3-carboxylate Openeye Name: [2-(4-methoxyphenyl)-2-oxo-ethyl] 2-(1-methyl-2,5-dioxo-pyrrolidin-3-yl)sulfanylpyridine-3-carboxylate CAS Name: 2-[(1-methyl-2,5-dioxo-3-pyrrolidinyl)thio]-3-pyridinecarboxylic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxyphenyl)-2-oxoethyl] 2-(1-methyl-2,5-dioxopyrrolidin-3-yl)sulfanylpyridine-3-carboxylate Traditional Name: 2-[(2,5-diketo-1-methyl-pyrrolidin-3-yl)thio]nicotinic acid [2-keto-2-(4-methoxyphenyl)ethyl] ester Formula: C20H18N2O6S MolecularWeight: 414.43172

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CC(C1=O)SC2=C(C=CC=N2)C(=O)OCC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CN1C(=O)CC(C1=O)SC2=C(C=CC=N2)C(=O)OCC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H18N2O6S/c1-22-17(24)10-16(19(22)25)29-18-14(4-3-9-21-18)20(26)28-11-15(23)12-5-7-13(27-2)8-6-12/h3-9,16H,10-11H2,1-2H3