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

Systemtic Name: 2-methoxyethyl (6R)-6-(4-ethoxyphenyl)-3-(3-fluoranyl-4-methyl-phenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl (6R)-6-(4-ethoxyphenyl)-3-(3-fluoro-4-methyl-phenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-6-(4-ethoxyphenyl)-3-(3-fluoro-4-methylphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (6R)-6-(4-ethoxyphenyl)-3-(3-fluoro-4-methylphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-3-(3-fluoro-4-methyl-phenyl)-4-methyl-6-p-phenetyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C24H27FN2O4S MolecularWeight: 458.545583

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27FN2O4S/c1-5-30-19-10-7-17(8-11-19)22-21(23(28)31-13-12-29-4)16(3)27(24(32)26-22)18-9-6-15(2)20(25)14-18/h6-11,14,22H,5,12-13H2,1-4H3,(H,26,32)/t22-/m1/s1