N-[2-(4-methylphenyl)sulfanylethyl]-3-phenoxy-propan-1-amine hydrochloride

Systemtic Name: N-[2-(4-methylphenyl)sulfanylethyl]-3-phenoxy-propan-1-amine hydrochloride Openeye Name: 3-phenoxy-N-[2-(p-tolylsulfanyl)ethyl]propan-1-amine hydrochloride CAS Name: N-[2-[(4-methylphenyl)thio]ethyl]-3-phenoxy-1-propanamine hydrochloride IUPAC Name: N-[2-(4-methylphenyl)sulfanylethyl]-3-phenoxypropan-1-amine hydrochloride Traditional Name: 3-phenoxypropyl-[2-(p-tolylthio)ethyl]amine hydrochloride Formula: C18H24ClNOS MolecularWeight: 337.90726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNCCCOC2=CC=CC=C2.Cl

Isomeric SMILES

CC1=CC=C(C=C1)SCCNCCCOC2=CC=CC=C2.Cl

InChI

InChI=1S/C18H23NOS.ClH/c1-16-8-10-18(11-9-16)21-15-13-19-12-5-14-20-17-6-3-2-4-7-17;/h2-4,6-11,19H,5,12-15H2,1H3;1H