5-azanyl-1-[[4-chloranyl-3-(trifluoromethyl)phenyl]methyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-azanyl-1-[[4-chloranyl-3-(trifluoromethyl)phenyl]methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-[[4-chloro-3-(trifluoromethyl)phenyl]methyl]triazole-4-carboxamide CAS Name: 5-amino-1-[[4-chloro-3-(trifluoromethyl)phenyl]methyl]-4-triazolecarboxamide IUPAC Name: 5-amino-1-[[4-chloro-3-(trifluoromethyl)phenyl]methyl]triazole-4-carboxamide Traditional Name: 5-amino-1-[4-chloro-3-(trifluoromethyl)benzyl]triazole-4-carboxamide Formula: C11H9ClF3N5O MolecularWeight: 319.67027

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CN2C(=C(N=N2)C(=O)N)N)C(F)(F)F)Cl

Isomeric SMILES

C1=CC(=C(C=C1CN2C(=C(N=N2)C(=O)N)N)C(F)(F)F)Cl

InChI

InChI=1S/C11H9ClF3N5O/c12-7-2-1-5(3-6(7)11(13,14)15)4-20-9(16)8(10(17)21)18-19-20/h1-3H,4,16H2,(H2,17,21)