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

Systemtic Name: 2-methoxyethyl (6S)-6-[2,6-bis(fluoranyl)phenyl]-3-cyclopentyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl (6S)-3-cyclopentyl-6-(2,6-difluorophenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-3-cyclopentyl-6-(2,6-difluorophenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (6S)-3-cyclopentyl-6-(2,6-difluorophenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-3-cyclopentyl-6-(2,6-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=C(C=CC=C3F)F)C(=O)OCCOC

Isomeric SMILES

CC1=C([C@H](NC(=S)N1C2CCCC2)C3=C(C=CC=C3F)F)C(=O)OCCOC

InChI

InChI=1S/C20H24F2N2O3S/c1-12-16(19(25)27-11-10-26-2)18(17-14(21)8-5-9-15(17)22)23-20(28)24(12)13-6-3-4-7-13/h5,8-9,13,18H,3-4,6-7,10-11H2,1-2H3,(H,23,28)/t18-/m0/s1