4-pyrrolidin-1-yl-2-(trifluoromethyl)benzenecarbothioamide

Systemtic Name: 4-pyrrolidin-1-yl-2-(trifluoromethyl)benzenecarbothioamide Openeye Name: 4-pyrrolidin-1-yl-2-(trifluoromethyl)benzenecarbothioamide CAS Name: 4-(1-pyrrolidinyl)-2-(trifluoromethyl)benzenecarbothioamide IUPAC Name: 4-pyrrolidin-1-yl-2-(trifluoromethyl)benzenecarbothioamide Traditional Name: 4-pyrrolidino-2-(trifluoromethyl)thiobenzamide Formula: C12H13F3N2S MolecularWeight: 274.30523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC(=C(C=C2)C(=S)N)C(F)(F)F

Isomeric SMILES

C1CCN(C1)C2=CC(=C(C=C2)C(=S)N)C(F)(F)F

InChI

InChI=1S/C12H13F3N2S/c13-12(14,15)10-7-8(17-5-1-2-6-17)3-4-9(10)11(16)18/h3-4,7H,1-2,5-6H2,(H2,16,18)