2-[(5-chloranyl-1H-indol-3-yl)methylsulfanyl]-1-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethanone

Systemtic Name: 2-[(5-chloranyl-1H-indol-3-yl)methylsulfanyl]-1-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethanone Openeye Name: 2-[(5-chloro-1H-indol-3-yl)methylsulfanyl]-1-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethanone CAS Name: 2-[(5-chloro-1H-indol-3-yl)methylthio]-1-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethanone IUPAC Name: 2-[(5-chloro-1H-indol-3-yl)methylsulfanyl]-1-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethanone Traditional Name: 2-[(5-chloro-1H-indol-3-yl)methylthio]-1-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethanone Formula: C22H21ClN2OS MolecularWeight: 396.93294

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(CC(N1)C(=O)CSCC2=CNC3=C2C=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

C1C=C(CC(N1)C(=O)CSCC2=CNC3=C2C=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H21ClN2OS/c23-18-6-7-20-19(11-18)17(12-25-20)13-27-14-22(26)21-10-16(8-9-24-21)15-4-2-1-3-5-15/h1-8,11-12,21,24-25H,9-10,13-14H2