N-methyl-2-pyridin-2-yl-1,3-oxathiane-2-carbothioamide

Systemtic Name: N-methyl-2-pyridin-2-yl-1,3-oxathiane-2-carbothioamide Openeye Name: N-methyl-2-(2-pyridyl)-1,3-oxathiane-2-carbothioamide CAS Name: N-methyl-2-(2-pyridinyl)-1,3-oxathiane-2-carbothioamide IUPAC Name: N-methyl-2-pyridin-2-yl-1,3-oxathiane-2-carbothioamide Traditional Name: N-methyl-2-(2-pyridyl)-1,3-oxathiane-2-carbothioamide Formula: C11H14N2OS2 MolecularWeight: 254.37166

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)C1(OCCCS1)C2=CC=CC=N2

Isomeric SMILES

CNC(=S)C1(OCCCS1)C2=CC=CC=N2

InChI

InChI=1S/C11H14N2OS2/c1-12-10(15)11(14-7-4-8-16-11)9-5-2-3-6-13-9/h2-3,5-6H,4,7-8H2,1H3,(H,12,15)