2-(2-fluoranylthiophen-3-yl)ethyl 4-(fluoranylmethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: 2-(2-fluoranylthiophen-3-yl)ethyl 4-(fluoranylmethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 2-(2-fluoro-3-thienyl)ethyl 4-(fluoromethyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(fluoromethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-(2-fluoro-3-thiophenyl)ethyl ester IUPAC Name: 2-(2-fluorothiophen-3-yl)ethyl 4-(fluoromethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(fluoromethyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-(2-fluoro-3-thienyl)ethyl ester Formula: C13H14F2N2O2S2 MolecularWeight: 332.389266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)CF)C(=O)OCCC2=C(SC=C2)F

Isomeric SMILES

CC1=C(C(NC(=S)N1)CF)C(=O)OCCC2=C(SC=C2)F

InChI

InChI=1S/C13H14F2N2O2S2/c1-7-10(9(6-14)17-13(20)16-7)12(18)19-4-2-8-3-5-21-11(8)15/h3,5,9H,2,4,6H2,1H3,(H2,16,17,20)