N-methyl-2-oxidanylidene-1-pyridin-3-yl-cyclohexane-1-carbothioamide

Systemtic Name: N-methyl-2-oxidanylidene-1-pyridin-3-yl-cyclohexane-1-carbothioamide Openeye Name: N-methyl-2-oxo-1-(3-pyridyl)cyclohexanecarbothioamide CAS Name: N-methyl-2-oxo-1-(3-pyridinyl)-1-cyclohexanecarbothioamide IUPAC Name: N-methyl-2-oxo-1-pyridin-3-ylcyclohexane-1-carbothioamide Traditional Name: 2-keto-N-methyl-1-(3-pyridyl)cyclohexanecarbothioamide Formula: C13H16N2OS MolecularWeight: 248.34394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2OS/c1-14-12(17)13(7-3-2-6-11(13)16)10-5-4-8-15-9-10/h4-5,8-9H,2-3,6-7H2,1H3,(H,14,17)