5-[3-(trifluoromethyl)phenyl]-1,2,4-thiadiazole-3-carboxylate

Systemtic Name: 5-[3-(trifluoromethyl)phenyl]-1,2,4-thiadiazole-3-carboxylate Openeye Name: 5-[3-(trifluoromethyl)phenyl]-1,2,4-thiadiazole-3-carboxylate CAS Name: 5-[3-(trifluoromethyl)phenyl]-1,2,4-thiadiazole-3-carboxylate IUPAC Name: 5-[3-(trifluoromethyl)phenyl]-1,2,4-thiadiazole-3-carboxylate Traditional Name: 5-[3-(trifluoromethyl)phenyl]-1,2,4-thiadiazole-3-carboxylate Formula: C10H4F3N2O2S- MolecularWeight: 273.21117

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)C2=NC(=NS2)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)C2=NC(=NS2)C(=O)[O-]

InChI

InChI=1S/C10H5F3N2O2S/c11-10(12,13)6-3-1-2-5(4-6)8-14-7(9(16)17)15-18-8/h1-4H,(H,16,17)/p-1