1-[2-(2-cyclohexylethylamino)-3-propan-2-ylsulfanyl-phenoxy]propan-2-ol hydrochloride

Systemtic Name: 1-[2-(2-cyclohexylethylamino)-3-propan-2-ylsulfanyl-phenoxy]propan-2-ol hydrochloride Openeye Name: 1-[2-(2-cyclohexylethylamino)-3-isopropylsulfanyl-phenoxy]propan-2-ol hydrochloride CAS Name: 1-[2-(2-cyclohexylethylamino)-3-(propan-2-ylthio)phenoxy]-2-propanol hydrochloride IUPAC Name: 1-[2-(2-cyclohexylethylamino)-3-propan-2-ylsulfanylphenoxy]propan-2-ol hydrochloride Traditional Name: 1-[2-(2-cyclohexylethylamino)-3-(isopropylthio)phenoxy]propan-2-ol hydrochloride Formula: C20H34ClNO2S MolecularWeight: 388.00746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=CC(=C1NCCC2CCCCC2)OCC(C)O.Cl

Isomeric SMILES

CC(C)SC1=CC=CC(=C1NCCC2CCCCC2)OCC(C)O.Cl

InChI

InChI=1S/C20H33NO2S.ClH/c1-15(2)24-19-11-7-10-18(23-14-16(3)22)20(19)21-13-12-17-8-5-4-6-9-17;/h7,10-11,15-17,21-22H,4-6,8-9,12-14H2,1-3H3;1H