2-[[4-azanyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenethyl-ethanamide

Systemtic Name: 2-[[4-azanyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]-N-phenethylacetamide IUPAC Name: 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenethylacetamide Traditional Name: 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]-N-phenethyl-acetamide Formula: C13H14F3N5OS MolecularWeight: 345.34337

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CSC2=NN=C(N2N)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CSC2=NN=C(N2N)C(F)(F)F

InChI

InChI=1S/C13H14F3N5OS/c14-13(15,16)11-19-20-12(21(11)17)23-8-10(22)18-7-6-9-4-2-1-3-5-9/h1-5H,6-8,17H2,(H,18,22)