methyl N'-(2,5-dimethylpyrazol-3-yl)carbamimidothioate hydroiodide

Systemtic Name: methyl N'-(2,5-dimethylpyrazol-3-yl)carbamimidothioate hydroiodide Openeye Name: 3-(2,5-dimethylpyrazol-3-yl)-2-methyl-isothiourea hydroiodide CAS Name: N'-(2,5-dimethyl-3-pyrazolyl)carbamimidothioic acid methyl ester hydroiodide IUPAC Name: methyl N'-(2,5-dimethylpyrazol-3-yl)carbamimidothioate hydroiodide Traditional Name: 3-(2,5-dimethylpyrazol-3-yl)-2-methyl-isothiourea hydroiodide Formula: C7H13IN4S MolecularWeight: 312.17439

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)N=C(N)SC)C.I

Isomeric SMILES

CC1=NN(C(=C1)/N=C(\N)/SC)C.I

InChI

InChI=1S/C7H12N4S.HI/c1-5-4-6(11(2)10-5)9-7(8)12-3;/h4H,1-3H3,(H2,8,9);1H