3-[2-[4-(4-bromophenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylsulfanylmethyl]-1H-indole

Systemtic Name: 3-[2-[4-(4-bromophenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylsulfanylmethyl]-1H-indole Openeye Name: 3-[2-[4-(4-bromophenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylsulfanylmethyl]-1H-indole CAS Name: 3-[[2-[4-(4-bromophenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylthio]methyl]-1H-indole IUPAC Name: 3-[2-[4-(4-bromophenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylsulfanylmethyl]-1H-indole Traditional Name: 3-[[2-[4-(4-bromophenyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylthio]methyl]-1H-indole Formula: C22H23BrN2S MolecularWeight: 427.40042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23BrN2S/c23-19-7-5-16(6-8-19)17-9-11-24-20(13-17)10-12-26-15-18-14-25-22-4-2-1-3-21(18)22/h1-9,14,20,24-25H,10-13,15H2