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

Systemtic Name: methyl N'-(2,5-dimethylpyrazol-3-yl)carbamimidothioate Openeye Name: 3-(2,5-dimethylpyrazol-3-yl)-2-methyl-isothiourea CAS Name: N'-(2,5-dimethyl-3-pyrazolyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N'-(2,5-dimethylpyrazol-3-yl)carbamimidothioate Traditional Name: 3-(2,5-dimethylpyrazol-3-yl)-2-methyl-isothiourea Formula: C7H12N4S MolecularWeight: 184.26198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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