sodium 3-pyridin-2-yl-5-(pyridin-2-ylcarbamoyl)-1,2,3-triazol-4-olate

Systemtic Name: sodium 3-pyridin-2-yl-5-(pyridin-2-ylcarbamoyl)-1,2,3-triazol-4-olate Openeye Name: sodium 3-(2-pyridyl)-5-(2-pyridylcarbamoyl)triazol-4-olate CAS Name: sodium 5-[oxo-(2-pyridinylamino)methyl]-3-(2-pyridinyl)-4-triazololate IUPAC Name: sodium 3-pyridin-2-yl-5-(pyridin-2-ylcarbamoyl)triazol-4-olate Traditional Name: sodium 3-(2-pyridyl)-5-(2-pyridylcarbamoyl)triazol-4-olate Formula: C13H9N6NaO2 MolecularWeight: 304.23933

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)NC(=O)C2=C(N(N=N2)C3=CC=CC=N3)[O-].[Na+]

Isomeric SMILES

C1=CC=NC(=C1)NC(=O)C2=C(N(N=N2)C3=CC=CC=N3)[O-].[Na+]

InChI

InChI=1S/C13H10N6O2.Na/c20-12(16-9-5-1-3-7-14-9)11-13(21)19(18-17-11)10-6-2-4-8-15-10;/h1-8,21H,(H,14,16,20);/q;+1/p-1