N-methyl-2-oxidanylidene-1-pyrimidin-5-yl-cyclohexane-1-carbothioamide

Systemtic Name: N-methyl-2-oxidanylidene-1-pyrimidin-5-yl-cyclohexane-1-carbothioamide Openeye Name: N-methyl-2-oxo-1-pyrimidin-5-yl-cyclohexanecarbothioamide CAS Name: N-methyl-2-oxo-1-(5-pyrimidinyl)-1-cyclohexanecarbothioamide IUPAC Name: N-methyl-2-oxo-1-pyrimidin-5-ylcyclohexane-1-carbothioamide Traditional Name: 2-keto-N-methyl-1-(5-pyrimidyl)cyclohexanecarbothioamide Formula: C12H15N3OS MolecularWeight: 249.332

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)C1(CCCCC1=O)C2=CN=CN=C2

Isomeric SMILES

CNC(=S)C1(CCCCC1=O)C2=CN=CN=C2

InChI

InChI=1S/C12H15N3OS/c1-13-11(17)12(5-3-2-4-10(12)16)9-6-14-8-15-7-9/h6-8H,2-5H2,1H3,(H,13,17)