1-methyl-2-(piperidin-1-ylmethylsulfanyl)pyridin-1-ium

Systemtic Name: 1-methyl-2-(piperidin-1-ylmethylsulfanyl)pyridin-1-ium Openeye Name: 1-methyl-2-(1-piperidylmethylsulfanyl)pyridin-1-ium CAS Name: 1-methyl-2-(1-piperidinylmethylthio)pyridin-1-ium IUPAC Name: 1-methyl-2-(piperidin-1-ylmethylsulfanyl)pyridin-1-ium Traditional Name: 1-methyl-2-(piperidinomethylthio)pyridin-1-ium Formula: C12H19N2S+ MolecularWeight: 223.35766

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1SCN2CCCCC2

Isomeric SMILES

C[N+]1=CC=CC=C1SCN2CCCCC2

InChI

InChI=1S/C12H19N2S/c1-13-8-6-3-7-12(13)15-11-14-9-4-2-5-10-14/h3,6-8H,2,4-5,9-11H2,1H3/q+1