thiophen-3-ylmethyl 4-(fluoranylmethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: thiophen-3-ylmethyl 4-(fluoranylmethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 3-thienylmethyl 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 3-thiophenylmethyl ester IUPAC Name: thiophen-3-ylmethyl 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 3-thenyl ester Formula: C12H13FN2O2S2 MolecularWeight: 300.372223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)CF)C(=O)OCC2=CSC=C2

Isomeric SMILES

CC1=C(C(NC(=S)N1)CF)C(=O)OCC2=CSC=C2

InChI

InChI=1S/C12H13FN2O2S2/c1-7-10(9(4-13)15-12(18)14-7)11(16)17-5-8-2-3-19-6-8/h2-3,6,9H,4-5H2,1H3,(H2,14,15,18)