2-methylpropyl (4S)-4-(2-chloranyl-6-fluoranyl-phenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: 2-methylpropyl (4S)-4-(2-chloranyl-6-fluoranyl-phenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: isobutyl (4S)-4-(2-chloro-6-fluoro-phenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(2-chloro-6-fluorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (4S)-4-(2-chloro-6-fluorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-(2-chloro-6-fluoro-phenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid isobutyl ester Formula: C16H18ClFN2O2S MolecularWeight: 356.842723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=C(C=CC=C2Cl)F)C(=O)OCC(C)C

Isomeric SMILES

CC1=C([C@H](NC(=S)N1)C2=C(C=CC=C2Cl)F)C(=O)OCC(C)C

InChI

InChI=1S/C16H18ClFN2O2S/c1-8(2)7-22-15(21)12-9(3)19-16(23)20-14(12)13-10(17)5-4-6-11(13)18/h4-6,8,14H,7H2,1-3H3,(H2,19,20,23)/t14-/m0/s1