(4R)-2-sulfanylidene-4-(trifluoromethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: (4R)-2-sulfanylidene-4-(trifluoromethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: (4R)-2-thioxo-4-(trifluoromethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-2-sulfanylidene-4-(trifluoromethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate IUPAC Name: (4R)-2-sulfanylidene-4-(trifluoromethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-2-thioxo-4-(trifluoromethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Formula: C6H4F3N2O2S- MolecularWeight: 225.16837

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(NC(=S)N1)C(F)(F)F)C(=O)[O-]

Isomeric SMILES

C1=C([C@@H](NC(=S)N1)C(F)(F)F)C(=O)[O-]

InChI

InChI=1S/C6H5F3N2O2S/c7-6(8,9)3-2(4(12)13)1-10-5(14)11-3/h1,3H,(H,12,13)(H2,10,11,14)/p-1/t3-/m1/s1