1-methyl-N-(4-methylsulfanylphenyl)piperidin-1-ium-4-amine

Systemtic Name: 1-methyl-N-(4-methylsulfanylphenyl)piperidin-1-ium-4-amine Openeye Name: 1-methyl-N-(4-methylsulfanylphenyl)piperidin-1-ium-4-amine CAS Name: 1-methyl-N-[4-(methylthio)phenyl]-4-piperidin-1-iumamine IUPAC Name: 1-methyl-N-(4-methylsulfanylphenyl)piperidin-1-ium-4-amine Traditional Name: (1-methylpiperidin-1-ium-4-yl)-[4-(methylthio)phenyl]amine Formula: C13H21N2S+ MolecularWeight: 237.38424

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)NC2=CC=C(C=C2)SC

Isomeric SMILES

C[NH+]1CCC(CC1)NC2=CC=C(C=C2)SC

InChI

InChI=1S/C13H20N2S/c1-15-9-7-12(8-10-15)14-11-3-5-13(16-2)6-4-11/h3-6,12,14H,7-10H2,1-2H3/p+1