3-[2,5-bis(chloranyl)phenyl]sulfanyl-N-methyl-hexan-1-amine hydrochloride

Systemtic Name: 3-[2,5-bis(chloranyl)phenyl]sulfanyl-N-methyl-hexan-1-amine hydrochloride Openeye Name: 3-(2,5-dichlorophenyl)sulfanyl-N-methyl-hexan-1-amine hydrochloride CAS Name: 3-[(2,5-dichlorophenyl)thio]-N-methyl-1-hexanamine hydrochloride IUPAC Name: 3-(2,5-dichlorophenyl)sulfanyl-N-methylhexan-1-amine hydrochloride Traditional Name: 3-[(2,5-dichlorophenyl)thio]hexyl-methyl-amine hydrochloride Formula: C13H20Cl3NS MolecularWeight: 328.7286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19Cl2NS.ClH/c1-3-4-11(7-8-16-2)17-13-9-10(14)5-6-12(13)15;/h5-6,9,11,16H,3-4,7-8H2,1-2H3;1H