2-[(7-bromanyl-1H-indol-3-yl)methylsulfanyl]-1-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethanone

Systemtic Name: 2-[(7-bromanyl-1H-indol-3-yl)methylsulfanyl]-1-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethanone Openeye Name: 2-[(7-bromo-1H-indol-3-yl)methylsulfanyl]-1-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethanone CAS Name: 2-[(7-bromo-1H-indol-3-yl)methylthio]-1-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethanone IUPAC Name: 2-[(7-bromo-1H-indol-3-yl)methylsulfanyl]-1-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethanone Traditional Name: 2-[(7-bromo-1H-indol-3-yl)methylthio]-1-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethanone Formula: C22H21BrN2OS MolecularWeight: 441.38394

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(CC(N1)C(=O)CSCC2=CNC3=C2C=CC=C3Br)C4=CC=CC=C4

Isomeric SMILES

C1C=C(CC(N1)C(=O)CSCC2=CNC3=C2C=CC=C3Br)C4=CC=CC=C4

InChI

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