N2-(1-ethyl-1-methyl-piperidin-1-ium-2-yl)-4-methylsulfanyl-benzene-1,2-diamine

Systemtic Name: N2-(1-ethyl-1-methyl-piperidin-1-ium-2-yl)-4-methylsulfanyl-benzene-1,2-diamine Openeye Name: N2-(1-ethyl-1-methyl-piperidin-1-ium-2-yl)-4-methylsulfanyl-benzene-1,2-diamine CAS Name: N2-(1-ethyl-1-methyl-2-piperidin-1-iumyl)-4-(methylthio)benzene-1,2-diamine IUPAC Name: 2-N-(1-ethyl-1-methylpiperidin-1-ium-2-yl)-4-methylsulfanylbenzene-1,2-diamine Traditional Name: [2-amino-5-(methylthio)phenyl]-(1-ethyl-1-methyl-piperidin-1-ium-2-yl)amine Formula: C15H26N3S+ MolecularWeight: 280.45204

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CCCCC1NC2=C(C=CC(=C2)SC)N)C

Isomeric SMILES

CC[N+]1(CCCCC1NC2=C(C=CC(=C2)SC)N)C

InChI

InChI=1S/C15H26N3S/c1-4-18(2)10-6-5-7-15(18)17-14-11-12(19-3)8-9-13(14)16/h8-9,11,15,17H,4-7,10,16H2,1-3H3/q+1