1-(1,5-dimethylpyrazol-4-yl)-2H-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-(1,5-dimethylpyrazol-4-yl)-2H-1,2,3,4-tetrazol-5-one Openeye Name: 1-(1,5-dimethylpyrazol-4-yl)-2H-tetrazol-5-one CAS Name: 1-(1,5-dimethyl-4-pyrazolyl)-2H-tetrazol-5-one IUPAC Name: 1-(1,5-dimethylpyrazol-4-yl)-2H-tetrazol-5-one Traditional Name: 1-(1,5-dimethylpyrazol-4-yl)-2H-tetrazol-5-one Formula: C6H8N6O MolecularWeight: 180.16732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)N2C(=O)N=NN2

Isomeric SMILES

CC1=C(C=NN1C)N2C(=O)N=NN2

InChI

InChI=1S/C6H8N6O/c1-4-5(3-7-11(4)2)12-6(13)8-9-10-12/h3H,1-2H3,(H,8,10,13)