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methyl-[3-(3-methylsulfanylpropylazaniumyl)propyl]-(phenylmethyl)azanium

methyl-[3-(3-methylsulfanylpropylazaniumyl)propyl]-(phenylmethyl)azanium

Systemtic Name:methyl-[3-(3-methylsulfanylpropylazaniumyl)propyl]-(phenylmethyl)azanium
Openeye Name:benzyl-methyl-[3-(3-methylsulfanylpropylammonio)propyl]ammonium
CAS Name:methyl-[3-[3-(methylthio)propylammonio]propyl]-(phenylmethyl)ammonium
IUPAC Name:benzyl-methyl-[3-(3-methylsulfanylpropylazaniumyl)propyl]azanium
Traditional Name:benzyl-methyl-[3-[3-(methylthio)propylammonio]propyl]ammonium
Formula: C15H28N2S+2
MolecularWeight: 268.46122
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C15H26N2S/c1-17(14-15-8-4-3-5-9-15)12-6-10-16-11-7-13-18-2/h3-5,8-9,16H,6-7,10-14H2,1-2H3/p+2


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