4-azanyl-1H-1,2,4-triazol-5-one hydrate

Systemtic Name: 4-azanyl-1H-1,2,4-triazol-5-one hydrate Openeye Name: 4-amino-1H-1,2,4-triazol-5-one hydrate CAS Name: 4-amino-1H-1,2,4-triazol-5-one hydrate IUPAC Name: 4-amino-1H-1,2,4-triazol-5-one hydrate Traditional Name: 4-amino-1H-1,2,4-triazol-5-one hydrate Formula: C2H6N4O2 MolecularWeight: 118.09464

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Descriptors Computed from Structure

Canonical SMILES:

C1=NNC(=O)N1N.O

Isomeric SMILES

C1=NNC(=O)N1N.O

InChI

InChI=1S/C2H4N4O.H2O/c3-6-1-4-5-2(6)7;/h1H,3H2,(H,5,7);1H2