2-(butylamino)-1-(4-ethylsulfanylphenyl)butan-1-ol hydrochloride

Systemtic Name: 2-(butylamino)-1-(4-ethylsulfanylphenyl)butan-1-ol hydrochloride Openeye Name: 2-(butylamino)-1-(4-ethylsulfanylphenyl)butan-1-ol hydrochloride CAS Name: 2-(butylamino)-1-[4-(ethylthio)phenyl]-1-butanol hydrochloride IUPAC Name: 2-(butylamino)-1-(4-ethylsulfanylphenyl)butan-1-ol hydrochloride Traditional Name: 2-(butylamino)-1-[4-(ethylthio)phenyl]butan-1-ol hydrochloride Formula: C16H28ClNOS MolecularWeight: 317.91762

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(CC)C(C1=CC=C(C=C1)SCC)O.Cl

Isomeric SMILES

CCCCNC(CC)C(C1=CC=C(C=C1)SCC)O.Cl

InChI

InChI=1S/C16H27NOS.ClH/c1-4-7-12-17-15(5-2)16(18)13-8-10-14(11-9-13)19-6-3;/h8-11,15-18H,4-7,12H2,1-3H3;1H