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

Systemtic Name: ethyl (6S)-6-[2,6-bis(fluoranyl)phenyl]-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl (6S)-6-(2,6-difluorophenyl)-4-methyl-3-propyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-6-(2,6-difluorophenyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (6S)-6-(2,6-difluorophenyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-6-(2,6-difluorophenyl)-4-methyl-3-propyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C17H20F2N2O2S MolecularWeight: 354.414706

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=S)C2=C(C=CC=C2F)F)C(=O)OCC)C

Isomeric SMILES

CCCN1C(=C([C@H](NC1=S)C2=C(C=CC=C2F)F)C(=O)OCC)C

InChI

InChI=1S/C17H20F2N2O2S/c1-4-9-21-10(3)13(16(22)23-5-2)15(20-17(21)24)14-11(18)7-6-8-12(14)19/h6-8,15H,4-5,9H2,1-3H3,(H,20,24)/t15-/m0/s1