(6-methyl-2-methylsulfanyl-pyrimidin-4-yl) carbamimidothioate

Systemtic Name: (6-methyl-2-methylsulfanyl-pyrimidin-4-yl) carbamimidothioate Openeye Name: 2-(6-methyl-2-methylsulfanyl-pyrimidin-4-yl)isothiourea CAS Name: carbamimidothioic acid [6-methyl-2-(methylthio)-4-pyrimidinyl] ester IUPAC Name: (6-methyl-2-methylsulfanylpyrimidin-4-yl) carbamimidothioate Traditional Name: 2-[6-methyl-2-(methylthio)pyrimidin-4-yl]isothiourea Formula: C7H10N4S2 MolecularWeight: 214.3111

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H10N4S2/c1-4-3-5(13-6(8)9)11-7(10-4)12-2/h3H,1-2H3,(H3,8,9)