ethyl 6-[(4-fluoranyl-3-methyl-phenyl)sulfonylmethyl]-4-(2-methoxyphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[(4-fluoranyl-3-methyl-phenyl)sulfonylmethyl]-4-(2-methoxyphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(4-fluoro-3-methyl-phenyl)sulfonylmethyl]-4-(2-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[(4-fluoro-3-methylphenyl)sulfonylmethyl]-4-(2-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(4-fluoro-3-methylphenyl)sulfonylmethyl]-4-(2-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[(4-fluoro-3-methyl-phenyl)sulfonylmethyl]-2-keto-4-(2-methoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H23FN2O6S MolecularWeight: 462.491223

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2OC)CS(=O)(=O)C3=CC(=C(C=C3)F)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2OC)CS(=O)(=O)C3=CC(=C(C=C3)F)C

InChI

InChI=1S/C22H23FN2O6S/c1-4-31-21(26)19-17(12-32(28,29)14-9-10-16(23)13(2)11-14)24-22(27)25-20(19)15-7-5-6-8-18(15)30-3/h5-11,20H,4,12H2,1-3H3,(H2,24,25,27)