4-[1-oxidanyl-2-(3-phenylsulfanylpropylamino)propyl]phenol

Systemtic Name: 4-[1-oxidanyl-2-(3-phenylsulfanylpropylamino)propyl]phenol Openeye Name: 4-[1-hydroxy-2-(3-phenylsulfanylpropylamino)propyl]phenol CAS Name: 4-[1-hydroxy-2-[3-(phenylthio)propylamino]propyl]phenol IUPAC Name: 4-[1-hydroxy-2-(3-phenylsulfanylpropylamino)propyl]phenol Traditional Name: 4-[1-hydroxy-2-[3-(phenylthio)propylamino]propyl]phenol Formula: C18H23NO2S MolecularWeight: 317.44572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=C(C=C1)O)O)NCCCSC2=CC=CC=C2

Isomeric SMILES

CC(C(C1=CC=C(C=C1)O)O)NCCCSC2=CC=CC=C2

InChI

InChI=1S/C18H23NO2S/c1-14(18(21)15-8-10-16(20)11-9-15)19-12-5-13-22-17-6-3-2-4-7-17/h2-4,6-11,14,18-21H,5,12-13H2,1H3