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

Systemtic Name: 2-methoxyethyl (6R)-6-[3,4-bis(fluoranyl)phenyl]-3-cyclopentyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl (6R)-3-cyclopentyl-6-(3,4-difluorophenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-3-cyclopentyl-6-(3,4-difluorophenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (6R)-3-cyclopentyl-6-(3,4-difluorophenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-3-cyclopentyl-6-(3,4-difluorophenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C20H24F2N2O3S MolecularWeight: 410.477966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C2CCCC2)C3=CC(=C(C=C3)F)F)C(=O)OCCOC

Isomeric SMILES

CC1=C([C@H](NC(=S)N1C2CCCC2)C3=CC(=C(C=C3)F)F)C(=O)OCCOC

InChI

InChI=1S/C20H24F2N2O3S/c1-12-17(19(25)27-10-9-26-2)18(13-7-8-15(21)16(22)11-13)23-20(28)24(12)14-5-3-4-6-14/h7-8,11,14,18H,3-6,9-10H2,1-2H3,(H,23,28)/t18-/m1/s1