(4-azanylpyrimidin-2-yl)methyl carbamimidothioate hydrochloride

Systemtic Name: (4-azanylpyrimidin-2-yl)methyl carbamimidothioate hydrochloride Openeye Name: 2-[(4-aminopyrimidin-2-yl)methyl]isothiourea hydrochloride CAS Name: carbamimidothioic acid (4-amino-2-pyrimidinyl)methyl ester hydrochloride IUPAC Name: (4-aminopyrimidin-2-yl)methyl carbamimidothioate hydrochloride Traditional Name: 2-[(4-aminopyrimidin-2-yl)methyl]isothiourea hydrochloride Formula: C6H10ClN5S MolecularWeight: 219.6951

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1N)CSC(=N)N.Cl

Isomeric SMILES

C1=CN=C(N=C1N)CSC(=N)N.Cl

InChI

InChI=1S/C6H9N5S.ClH/c7-4-1-2-10-5(11-4)3-12-6(8)9;/h1-2H,3H2,(H3,8,9)(H2,7,10,11);1H