4,6-dimethyl-2-(2-piperidin-1-ium-1-ylethylsulfanyl)pyrimidine chloride

Systemtic Name: 4,6-dimethyl-2-(2-piperidin-1-ium-1-ylethylsulfanyl)pyrimidine chloride Openeye Name: 4,6-dimethyl-2-(2-piperidin-1-ium-1-ylethylsulfanyl)pyrimidine chloride CAS Name: 4,6-dimethyl-2-[2-(1-piperidin-1-iumyl)ethylthio]pyrimidine chloride IUPAC Name: 4,6-dimethyl-2-(2-piperidin-1-ium-1-ylethylsulfanyl)pyrimidine chloride Traditional Name: 4,6-dimethyl-2-(2-piperidin-1-ium-1-ylethylthio)pyrimidine chloride Formula: C13H22ClN3S MolecularWeight: 287.85188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC[NH+]2CCCCC2)C.[Cl-]

Isomeric SMILES

CC1=CC(=NC(=N1)SCC[NH+]2CCCCC2)C.[Cl-]

InChI

InChI=1S/C13H21N3S.ClH/c1-11-10-12(2)15-13(14-11)17-9-8-16-6-4-3-5-7-16;/h10H,3-9H2,1-2H3;1H