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

Systemtic Name: 2-methoxyethyl (6R)-6-[3,4-bis(fluoranyl)phenyl]-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl (6R)-6-(3,4-difluorophenyl)-4-methyl-3-phenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-6-(3,4-difluorophenyl)-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (6R)-6-(3,4-difluorophenyl)-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-6-(3,4-difluorophenyl)-4-methyl-3-phenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C21H20F2N2O3S MolecularWeight: 418.456906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C2=CC=CC=C2)C3=CC(=C(C=C3)F)F)C(=O)OCCOC

Isomeric SMILES

CC1=C([C@H](NC(=S)N1C2=CC=CC=C2)C3=CC(=C(C=C3)F)F)C(=O)OCCOC

InChI

InChI=1S/C21H20F2N2O3S/c1-13-18(20(26)28-11-10-27-2)19(14-8-9-16(22)17(23)12-14)24-21(29)25(13)15-6-4-3-5-7-15/h3-9,12,19H,10-11H2,1-2H3,(H,24,29)/t19-/m1/s1