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

Systemtic Name: 2-thiophen-3-ylethyl 6-methyl-2-sulfanylidene-4-(trifluoromethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 2-(3-thienyl)ethyl 6-methyl-2-thioxo-4-(trifluoromethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-2-sulfanylidene-4-(trifluoromethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-(3-thiophenyl)ethyl ester IUPAC Name: 2-thiophen-3-ylethyl 6-methyl-2-sulfanylidene-4-(trifluoromethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-2-thioxo-4-(trifluoromethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-(3-thienyl)ethyl ester Formula: C13H13F3N2O2S2 MolecularWeight: 350.37973

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13F3N2O2S2/c1-7-9(10(13(14,15)16)18-12(21)17-7)11(19)20-4-2-8-3-5-22-6-8/h3,5-6,10H,2,4H2,1H3,(H2,17,18,21)