methyl (6R)-6-(3-ethoxy-4-methoxy-phenyl)-3-(3-fluoranyl-4-methyl-phenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl (6R)-6-(3-ethoxy-4-methoxy-phenyl)-3-(3-fluoranyl-4-methyl-phenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl (6R)-6-(3-ethoxy-4-methoxy-phenyl)-3-(3-fluoro-4-methyl-phenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-6-(3-ethoxy-4-methoxyphenyl)-3-(3-fluoro-4-methylphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (6R)-6-(3-ethoxy-4-methoxyphenyl)-3-(3-fluoro-4-methylphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-6-(3-ethoxy-4-methoxy-phenyl)-3-(3-fluoro-4-methyl-phenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C23H25FN2O4S MolecularWeight: 444.519003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(N(C(=S)N2)C3=CC(=C(C=C3)C)F)C)C(=O)OC)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)[C@@H]2C(=C(N(C(=S)N2)C3=CC(=C(C=C3)C)F)C)C(=O)OC)OC

InChI

InChI=1S/C23H25FN2O4S/c1-6-30-19-11-15(8-10-18(19)28-4)21-20(22(27)29-5)14(3)26(23(31)25-21)16-9-7-13(2)17(24)12-16/h7-12,21H,6H2,1-5H3,(H,25,31)/t21-/m1/s1