1-(phenylmethyl)pyrazole-3,4-diamine hydrate dihydrochloride

Systemtic Name: 1-(phenylmethyl)pyrazole-3,4-diamine hydrate dihydrochloride Openeye Name: 1-benzylpyrazole-3,4-diamine hydrate dihydrochloride CAS Name: 1-(phenylmethyl)pyrazole-3,4-diamine hydrate dihydrochloride IUPAC Name: 1-benzylpyrazole-3,4-diamine hydrate dihydrochloride Traditional Name: (3-amino-1-benzyl-pyrazol-4-yl)amine hydrate dihydrochloride Formula: C10H16Cl2N4O MolecularWeight: 279.16624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)N)N.O.Cl.Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)N)N.O.Cl.Cl

InChI

InChI=1S/C10H12N4.2ClH.H2O/c11-9-7-14(13-10(9)12)6-8-4-2-1-3-5-8;;;/h1-5,7H,6,11H2,(H2,12,13);2*1H;1H2