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

Systemtic Name: 1-[4-(4-bromophenyl)-1,2,3,6-tetrahydropyridin-2-yl]-2-(1H-indol-3-ylmethylsulfanyl)ethanone Openeye Name: 1-[4-(4-bromophenyl)-1,2,3,6-tetrahydropyridin-2-yl]-2-(1H-indol-3-ylmethylsulfanyl)ethanone CAS Name: 1-[4-(4-bromophenyl)-1,2,3,6-tetrahydropyridin-2-yl]-2-(1H-indol-3-ylmethylthio)ethanone IUPAC Name: 1-[4-(4-bromophenyl)-1,2,3,6-tetrahydropyridin-2-yl]-2-(1H-indol-3-ylmethylsulfanyl)ethanone Traditional Name: 1-[4-(4-bromophenyl)-1,2,3,6-tetrahydropyridin-2-yl]-2-(1H-indol-3-ylmethylthio)ethanone Formula: C22H21BrN2OS MolecularWeight: 441.38394

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(CC(N1)C(=O)CSCC2=CNC3=CC=CC=C32)C4=CC=C(C=C4)Br

Isomeric SMILES

C1C=C(CC(N1)C(=O)CSCC2=CNC3=CC=CC=C32)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H21BrN2OS/c23-18-7-5-15(6-8-18)16-9-10-24-21(11-16)22(26)14-27-13-17-12-25-20-4-2-1-3-19(17)20/h1-9,12,21,24-25H,10-11,13-14H2