N-(3-methylsulfanylphenyl)-1-propyl-piperidin-1-ium-4-amine

Systemtic Name: N-(3-methylsulfanylphenyl)-1-propyl-piperidin-1-ium-4-amine Openeye Name: N-(3-methylsulfanylphenyl)-1-propyl-piperidin-1-ium-4-amine CAS Name: N-[3-(methylthio)phenyl]-1-propyl-4-piperidin-1-iumamine IUPAC Name: N-(3-methylsulfanylphenyl)-1-propylpiperidin-1-ium-4-amine Traditional Name: [3-(methylthio)phenyl]-(1-propylpiperidin-1-ium-4-yl)amine Formula: C15H25N2S+ MolecularWeight: 265.4374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24N2S/c1-3-9-17-10-7-13(8-11-17)16-14-5-4-6-15(12-14)18-2/h4-6,12-13,16H,3,7-11H2,1-2H3/p+1