methyl 4-(methylamino)-3-[3-(trifluoromethyl)phenyl]-1,2-thiazole-5-carboxylate

Systemtic Name: methyl 4-(methylamino)-3-[3-(trifluoromethyl)phenyl]-1,2-thiazole-5-carboxylate Openeye Name: methyl 4-(methylamino)-3-[3-(trifluoromethyl)phenyl]isothiazole-5-carboxylate CAS Name: 4-(methylamino)-3-[3-(trifluoromethyl)phenyl]-5-isothiazolecarboxylic acid methyl ester IUPAC Name: methyl 4-(methylamino)-3-[3-(trifluoromethyl)phenyl]-1,2-thiazole-5-carboxylate Traditional Name: 4-(methylamino)-3-[3-(trifluoromethyl)phenyl]isothiazole-5-carboxylic acid methyl ester Formula: C13H11F3N2O2S MolecularWeight: 316.29885

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(SN=C1C2=CC(=CC=C2)C(F)(F)F)C(=O)OC

Isomeric SMILES

CNC1=C(SN=C1C2=CC(=CC=C2)C(F)(F)F)C(=O)OC

InChI

InChI=1S/C13H11F3N2O2S/c1-17-10-9(18-21-11(10)12(19)20-2)7-4-3-5-8(6-7)13(14,15)16/h3-6,17H,1-2H3