dimethyl-[3-[(4-methylsulfanylphenyl)methylazaniumyl]propyl]azanium

Systemtic Name: dimethyl-[3-[(4-methylsulfanylphenyl)methylazaniumyl]propyl]azanium Openeye Name: dimethyl-[3-[(4-methylsulfanylphenyl)methylammonio]propyl]ammonium CAS Name: dimethyl-[3-[[4-(methylthio)phenyl]methylammonio]propyl]ammonium IUPAC Name: dimethyl-[3-[(4-methylsulfanylphenyl)methylazaniumyl]propyl]azanium Traditional Name: dimethyl-[3-[[4-(methylthio)benzyl]ammonio]propyl]ammonium Formula: C13H24N2S+2 MolecularWeight: 240.40806

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC[NH2+]CC1=CC=C(C=C1)SC

Isomeric SMILES

C[NH+](C)CCC[NH2+]CC1=CC=C(C=C1)SC

InChI

InChI=1S/C13H22N2S/c1-15(2)10-4-9-14-11-12-5-7-13(16-3)8-6-12/h5-8,14H,4,9-11H2,1-3H3/p+2