[2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]-(3-methylsulfanylpropyl)azanium

Systemtic Name: [2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]-(3-methylsulfanylpropyl)azanium Openeye Name: [2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]-(3-methylsulfanylpropyl)ammonium CAS Name: [2-methyl-2-(4-methyl-1-piperazin-4-iumyl)propyl]-[3-(methylthio)propyl]ammonium IUPAC Name: [2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]-(3-methylsulfanylpropyl)azanium Traditional Name: [2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]-[3-(methylthio)propyl]ammonium Formula: C13H31N3S+2 MolecularWeight: 261.47034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[NH2+]CCCSC)N1CC[NH+](CC1)C

Isomeric SMILES

CC(C)(C[NH2+]CCCSC)N1CC[NH+](CC1)C

InChI

InChI=1S/C13H29N3S/c1-13(2,12-14-6-5-11-17-4)16-9-7-15(3)8-10-16/h14H,5-12H2,1-4H3/p+2