5-[[3-(trifluoromethyl)phenyl]carbamoylamino]-2H-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-[[3-(trifluoromethyl)phenyl]carbamoylamino]-2H-1,2,3-triazole-4-carboxamide Openeye Name: 5-[[3-(trifluoromethyl)phenyl]carbamoylamino]-2H-triazole-4-carboxamide CAS Name: 5-[[oxo-[3-(trifluoromethyl)anilino]methyl]amino]-2H-triazole-4-carboxamide IUPAC Name: 5-[[3-(trifluoromethyl)phenyl]carbamoylamino]-2H-triazole-4-carboxamide Traditional Name: 5-[[3-(trifluoromethyl)phenyl]carbamoylamino]-2H-triazole-4-carboxamide Formula: C11H9F3N6O2 MolecularWeight: 314.22337

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)NC2=NNN=C2C(=O)N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)NC2=NNN=C2C(=O)N)C(F)(F)F

InChI

InChI=1S/C11H9F3N6O2/c12-11(13,14)5-2-1-3-6(4-5)16-10(22)17-9-7(8(15)21)18-20-19-9/h1-4H,(H2,15,21)(H3,16,17,18,19,20,22)