2,2-dimethyl-N-[3-(4-propan-2-ylsulfanylphenoxy)propyl]hexan-1-amine hydrochloride

Systemtic Name: 2,2-dimethyl-N-[3-(4-propan-2-ylsulfanylphenoxy)propyl]hexan-1-amine hydrochloride Openeye Name: N-[3-(4-isopropylsulfanylphenoxy)propyl]-2,2-dimethyl-hexan-1-amine hydrochloride CAS Name: 2,2-dimethyl-N-[3-[4-(propan-2-ylthio)phenoxy]propyl]-1-hexanamine hydrochloride IUPAC Name: 2,2-dimethyl-N-[3-(4-propan-2-ylsulfanylphenoxy)propyl]hexan-1-amine hydrochloride Traditional Name: 2,2-dimethylhexyl-[3-[4-(isopropylthio)phenoxy]propyl]amine hydrochloride Formula: C20H36ClNOS MolecularWeight: 374.02394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)CNCCCOC1=CC=C(C=C1)SC(C)C.Cl

Isomeric SMILES

CCCCC(C)(C)CNCCCOC1=CC=C(C=C1)SC(C)C.Cl

InChI

InChI=1S/C20H35NOS.ClH/c1-6-7-13-20(4,5)16-21-14-8-15-22-18-9-11-19(12-10-18)23-17(2)3;/h9-12,17,21H,6-8,13-16H2,1-5H3;1H