2-(3-azanyl-1H-1,2,4-triazol-5-yl)-1H-pyridin-2-amine hydrate

Systemtic Name: 2-(3-azanyl-1H-1,2,4-triazol-5-yl)-1H-pyridin-2-amine hydrate Openeye Name: 2-(3-amino-1H-1,2,4-triazol-5-yl)-1H-pyridin-2-amine hydrate CAS Name: 2-(3-amino-1H-1,2,4-triazol-5-yl)-1H-pyridin-2-amine hydrate IUPAC Name: 2-(3-amino-1H-1,2,4-triazol-5-yl)-1H-pyridin-2-amine hydrate Traditional Name: [5-(2-amino-1H-pyridin-2-yl)-1H-1,2,4-triazol-3-yl]amine hydrate Formula: C7H12N6O MolecularWeight: 196.20978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(NC=C1)(C2=NC(=NN2)N)N.O

Isomeric SMILES

C1=CC(NC=C1)(C2=NC(=NN2)N)N.O

InChI

InChI=1S/C7H10N6.H2O/c8-6-11-5(12-13-6)7(9)3-1-2-4-10-7;/h1-4,10H,9H2,(H3,8,11,12,13);1H2