3-[1-[2-[[5-(hydroxymethyl)-1H-indol-3-yl]methylsulfanyl]ethyl]piperidin-3-yl]phenol

Systemtic Name: 3-[1-[2-[[5-(hydroxymethyl)-1H-indol-3-yl]methylsulfanyl]ethyl]piperidin-3-yl]phenol Openeye Name: 3-[1-[2-[[5-(hydroxymethyl)-1H-indol-3-yl]methylsulfanyl]ethyl]-3-piperidyl]phenol CAS Name: 3-[1-[2-[[5-(hydroxymethyl)-1H-indol-3-yl]methylthio]ethyl]-3-piperidinyl]phenol IUPAC Name: 3-[1-[2-[[5-(hydroxymethyl)-1H-indol-3-yl]methylsulfanyl]ethyl]piperidin-3-yl]phenol Traditional Name: 3-[1-[2-[(5-methylol-1H-indol-3-yl)methylthio]ethyl]-3-piperidyl]phenol Formula: C23H28N2O2S MolecularWeight: 396.54562

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCSCC2=CNC3=C2C=C(C=C3)CO)C4=CC(=CC=C4)O

Isomeric SMILES

C1CC(CN(C1)CCSCC2=CNC3=C2C=C(C=C3)CO)C4=CC(=CC=C4)O

InChI

InChI=1S/C23H28N2O2S/c26-15-17-6-7-23-22(11-17)20(13-24-23)16-28-10-9-25-8-2-4-19(14-25)18-3-1-5-21(27)12-18/h1,3,5-7,11-13,19,24,26-27H,2,4,8-10,14-16H2