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

Systemtic Name: 3-(2-fluoranylthiophen-3-yl)propyl 4-(hydroxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 3-(2-fluoro-3-thienyl)propyl 4-(hydroxymethyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(hydroxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 3-(2-fluoro-3-thiophenyl)propyl ester IUPAC Name: 3-(2-fluorothiophen-3-yl)propyl 4-(hydroxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-4-methylol-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 3-(2-fluoro-3-thienyl)propyl ester Formula: C14H17FN2O3S2 MolecularWeight: 344.424783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)CO)C(=O)OCCCC2=C(SC=C2)F

Isomeric SMILES

CC1=C(C(NC(=S)N1)CO)C(=O)OCCCC2=C(SC=C2)F

InChI

InChI=1S/C14H17FN2O3S2/c1-8-11(10(7-18)17-14(21)16-8)13(19)20-5-2-3-9-4-6-22-12(9)15/h4,6,10,18H,2-3,5,7H2,1H3,(H2,16,17,21)