[6-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-4-oxidanylidene-pyran-3-yl] 1-(4-methoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [6-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-4-oxidanylidene-pyran-3-yl] 1-(4-methoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [6-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-4-oxo-pyran-3-yl] 1-(4-methoxyphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-(4-methoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [6-[[(4-methyl-2-pyrimidinyl)thio]methyl]-4-oxo-3-pyranyl] ester IUPAC Name: [6-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-4-oxopyran-3-yl] 1-(4-methoxyphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 5-keto-1-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid [4-keto-6-[[(4-methylpyrimidin-2-yl)thio]methyl]pyran-3-yl] ester Formula: C23H21N3O6S MolecularWeight: 467.49434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SCC2=CC(=O)C(=CO2)OC(=O)C3CC(=O)N(C3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=NC(=NC=C1)SCC2=CC(=O)C(=CO2)OC(=O)C3CC(=O)N(C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C23H21N3O6S/c1-14-7-8-24-23(25-14)33-13-18-10-19(27)20(12-31-18)32-22(29)15-9-21(28)26(11-15)16-3-5-17(30-2)6-4-16/h3-8,10,12,15H,9,11,13H2,1-2H3