3-(pyrimidin-2-ylamino)-N-(1H-1,2,4-triazol-5-yl)benzamide

Systemtic Name: 3-(pyrimidin-2-ylamino)-N-(1H-1,2,4-triazol-5-yl)benzamide Openeye Name: 3-(pyrimidin-2-ylamino)-N-(1H-1,2,4-triazol-5-yl)benzamide CAS Name: 3-(2-pyrimidinylamino)-N-(1H-1,2,4-triazol-5-yl)benzamide IUPAC Name: 3-(pyrimidin-2-ylamino)-N-(1H-1,2,4-triazol-5-yl)benzamide Traditional Name: 3-(2-pyrimidylamino)-N-(1H-1,2,4-triazol-5-yl)benzamide Formula: C13H11N7O MolecularWeight: 281.27274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC=CC=N2)C(=O)NC3=NC=NN3

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC=CC=N2)C(=O)NC3=NC=NN3

InChI

InChI=1S/C13H11N7O/c21-11(19-13-16-8-17-20-13)9-3-1-4-10(7-9)18-12-14-5-2-6-15-12/h1-8H,(H,14,15,18)(H2,16,17,19,20,21)