4-chloranyl-2-[1-(methylamino)hexan-3-ylsulfanyl]benzenecarbonitrile hydrochloride

Systemtic Name: 4-chloranyl-2-[1-(methylamino)hexan-3-ylsulfanyl]benzenecarbonitrile hydrochloride Openeye Name: 4-chloro-2-[1-[2-(methylamino)ethyl]butylsulfanyl]benzonitrile hydrochloride CAS Name: 4-chloro-2-[1-(methylamino)hexan-3-ylthio]benzonitrile hydrochloride IUPAC Name: 4-chloro-2-[1-(methylamino)hexan-3-ylsulfanyl]benzonitrile hydrochloride Traditional Name: 4-chloro-2-[1-[2-(methylamino)ethyl]butylthio]benzonitrile hydrochloride Formula: C14H20Cl2N2S MolecularWeight: 319.293

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCNC)SC1=C(C=CC(=C1)Cl)C#N.Cl

Isomeric SMILES

CCCC(CCNC)SC1=C(C=CC(=C1)Cl)C#N.Cl

InChI

InChI=1S/C14H19ClN2S.ClH/c1-3-4-13(7-8-17-2)18-14-9-12(15)6-5-11(14)10-16;/h5-6,9,13,17H,3-4,7-8H2,1-2H3;1H