2-phenylsulfanylethyl-[2-[2-(2-phenylsulfanylethylazaniumyl)ethyldisulfanyl]ethyl]azanium dichloride

Systemtic Name: 2-phenylsulfanylethyl-[2-[2-(2-phenylsulfanylethylazaniumyl)ethyldisulfanyl]ethyl]azanium dichloride Openeye Name: 2-phenylsulfanylethyl-[2-[2-(2-phenylsulfanylethylammonio)ethyldisulfanyl]ethyl]ammonium dichloride CAS Name: 2-(phenylthio)ethyl-[2-[2-[2-(phenylthio)ethylammonio]ethyldisulfanyl]ethyl]ammonium dichloride IUPAC Name: 2-phenylsulfanylethyl-[2-[2-(2-phenylsulfanylethylazaniumyl)ethyldisulfanyl]ethyl]azanium dichloride Traditional Name: 2-(phenylthio)ethyl-[2-[2-[2-(phenylthio)ethylammonio]ethyldisulfanyl]ethyl]ammonium dichloride Formula: C20H30Cl2N2S4 MolecularWeight: 497.6316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC[NH2+]CCSSCC[NH2+]CCSC2=CC=CC=C2.[Cl-].[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)SCC[NH2+]CCSSCC[NH2+]CCSC2=CC=CC=C2.[Cl-].[Cl-]

InChI

InChI=1S/C20H28N2S4.2ClH/c1-3-7-19(8-4-1)23-15-11-21-13-17-25-26-18-14-22-12-16-24-20-9-5-2-6-10-20;;/h1-10,21-22H,11-18H2;2*1H