3-[[2-(decylamino)ethyldisulfanyl]methyl]benzenecarbonitrile hydrochloride

Systemtic Name: 3-[[2-(decylamino)ethyldisulfanyl]methyl]benzenecarbonitrile hydrochloride Openeye Name: 3-[[2-(decylamino)ethyldisulfanyl]methyl]benzonitrile hydrochloride CAS Name: 3-[[2-(decylamino)ethyldisulfanyl]methyl]benzonitrile hydrochloride IUPAC Name: 3-[[2-(decylamino)ethyldisulfanyl]methyl]benzonitrile hydrochloride Traditional Name: 3-[[2-(decylamino)ethyldisulfanyl]methyl]benzonitrile hydrochloride Formula: C20H33ClN2S2 MolecularWeight: 401.07242

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCNCCSSCC1=CC=CC(=C1)C#N.Cl

Isomeric SMILES

CCCCCCCCCCNCCSSCC1=CC=CC(=C1)C#N.Cl

InChI

InChI=1S/C20H32N2S2.ClH/c1-2-3-4-5-6-7-8-9-13-22-14-15-23-24-18-20-12-10-11-19(16-20)17-21;/h10-12,16,22H,2-9,13-15,18H2,1H3;1H