5-chloranyl-2-hexadecylsulfanyl-aniline hydrochloride

Systemtic Name: 5-chloranyl-2-hexadecylsulfanyl-aniline hydrochloride Openeye Name: 5-chloro-2-hexadecylsulfanyl-aniline hydrochloride CAS Name: 5-chloro-2-(hexadecylthio)aniline hydrochloride IUPAC Name: 5-chloro-2-hexadecylsulfanylaniline hydrochloride Traditional Name: [2-(cetylthio)-5-chloro-phenyl]amine hydrochloride Formula: C22H39Cl2NS MolecularWeight: 420.52276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSC1=C(C=C(C=C1)Cl)N.Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCSC1=C(C=C(C=C1)Cl)N.Cl

InChI

InChI=1S/C22H38ClNS.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-25-22-17-16-20(23)19-21(22)24;/h16-17,19H,2-15,18,24H2,1H3;1H