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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(NC)SC1=C(C=CC(=C1)Cl)Cl.Cl

Isomeric SMILES

CCCCCC(NC)SC1=C(C=CC(=C1)Cl)Cl.Cl

InChI

InChI=1S/C13H19Cl2NS.ClH/c1-3-4-5-6-13(16-2)17-12-9-10(14)7-8-11(12)15;/h7-9,13,16H,3-6H2,1-2H3;1H