2-(2-piperidin-1-ium-1-ylethylsulfanyl)aniline

Systemtic Name: 2-(2-piperidin-1-ium-1-ylethylsulfanyl)aniline Openeye Name: 2-(2-piperidin-1-ium-1-ylethylsulfanyl)aniline CAS Name: 2-[2-(1-piperidin-1-iumyl)ethylthio]aniline IUPAC Name: 2-(2-piperidin-1-ium-1-ylethylsulfanyl)aniline Traditional Name: [2-(2-piperidin-1-ium-1-ylethylthio)phenyl]amine Formula: C13H21N2S+ MolecularWeight: 237.38424

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCSC2=CC=CC=C2N

Isomeric SMILES

C1CC[NH+](CC1)CCSC2=CC=CC=C2N

InChI

InChI=1S/C13H20N2S/c14-12-6-2-3-7-13(12)16-11-10-15-8-4-1-5-9-15/h2-3,6-7H,1,4-5,8-11,14H2/p+1