methyl N'-(2,6-dimethylpyrimidin-4-yl)carbamimidothioate

Systemtic Name: methyl N'-(2,6-dimethylpyrimidin-4-yl)carbamimidothioate Openeye Name: 3-(2,6-dimethylpyrimidin-4-yl)-2-methyl-isothiourea CAS Name: N'-(2,6-dimethyl-4-pyrimidinyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N'-(2,6-dimethylpyrimidin-4-yl)carbamimidothioate Traditional Name: 3-(2,6-dimethylpyrimidin-4-yl)-2-methyl-isothiourea Formula: C8H12N4S MolecularWeight: 196.27268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C)N=C(N)SC

Isomeric SMILES

CC1=CC(=NC(=N1)C)N=C(N)SC

InChI

InChI=1S/C8H12N4S/c1-5-4-7(11-6(2)10-5)12-8(9)13-3/h4H,1-3H3,(H2,9,10,11,12)