3-[2-[2-(1H-indol-3-ylmethylsulfanyl)ethyl]-1,2,3,6-tetrahydropyridin-4-yl]phenol

Systemtic Name: 3-[2-[2-(1H-indol-3-ylmethylsulfanyl)ethyl]-1,2,3,6-tetrahydropyridin-4-yl]phenol Openeye Name: 3-[2-[2-(1H-indol-3-ylmethylsulfanyl)ethyl]-1,2,3,6-tetrahydropyridin-4-yl]phenol CAS Name: 3-[2-[2-(1H-indol-3-ylmethylthio)ethyl]-1,2,3,6-tetrahydropyridin-4-yl]phenol IUPAC Name: 3-[2-[2-(1H-indol-3-ylmethylsulfanyl)ethyl]-1,2,3,6-tetrahydropyridin-4-yl]phenol Traditional Name: 3-[2-[2-(1H-indol-3-ylmethylthio)ethyl]-1,2,3,6-tetrahydropyridin-4-yl]phenol Formula: C22H24N2OS MolecularWeight: 364.50376

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(CC(N1)CCSCC2=CNC3=CC=CC=C32)C4=CC(=CC=C4)O

Isomeric SMILES

C1C=C(CC(N1)CCSCC2=CNC3=CC=CC=C32)C4=CC(=CC=C4)O

InChI

InChI=1S/C22H24N2OS/c25-20-5-3-4-16(13-20)17-8-10-23-19(12-17)9-11-26-15-18-14-24-22-7-2-1-6-21(18)22/h1-8,13-14,19,23-25H,9-12,15H2