(4-methylsulfanylphenyl)methyl-(3-pyrrolidin-1-ium-1-ylpropyl)azanium

Systemtic Name: (4-methylsulfanylphenyl)methyl-(3-pyrrolidin-1-ium-1-ylpropyl)azanium Openeye Name: (4-methylsulfanylphenyl)methyl-(3-pyrrolidin-1-ium-1-ylpropyl)ammonium CAS Name: [4-(methylthio)phenyl]methyl-[3-(1-pyrrolidin-1-iumyl)propyl]ammonium IUPAC Name: (4-methylsulfanylphenyl)methyl-(3-pyrrolidin-1-ium-1-ylpropyl)azanium Traditional Name: [4-(methylthio)benzyl]-(3-pyrrolidin-1-ium-1-ylpropyl)ammonium Formula: C15H26N2S+2 MolecularWeight: 266.44534

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C[NH2+]CCC[NH+]2CCCC2

Isomeric SMILES

CSC1=CC=C(C=C1)C[NH2+]CCC[NH+]2CCCC2

InChI

InChI=1S/C15H24N2S/c1-18-15-7-5-14(6-8-15)13-16-9-4-12-17-10-2-3-11-17/h5-8,16H,2-4,9-13H2,1H3/p+2