5-[bis(1H-1,2,4-triazol-5-yl)phosphoryl]-1H-1,2,4-triazole

Systemtic Name: 5-[bis(1H-1,2,4-triazol-5-yl)phosphoryl]-1H-1,2,4-triazole Openeye Name: 5-[bis(1H-1,2,4-triazol-5-yl)phosphoryl]-1H-1,2,4-triazole CAS Name: 5-[bis(1H-1,2,4-triazol-5-yl)phosphoryl]-1H-1,2,4-triazole IUPAC Name: 5-[bis(1H-1,2,4-triazol-5-yl)phosphoryl]-1H-1,2,4-triazole Traditional Name: 5-[bis(1H-1,2,4-triazol-5-yl)phosphoryl]-1H-1,2,4-triazole Formula: C6H6N9OP MolecularWeight: 251.145301

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Descriptors Computed from Structure

Canonical SMILES:

C1=NNC(=N1)P(=O)(C2=NC=NN2)C3=NC=NN3

Isomeric SMILES

C1=NNC(=N1)P(=O)(C2=NC=NN2)C3=NC=NN3

InChI

InChI=1S/C6H6N9OP/c16-17(4-7-1-10-13-4,5-8-2-11-14-5)6-9-3-12-15-6/h1-3H,(H,7,10,13)(H,8,11,14)(H,9,12,15)