5-bromanyl-3-[1-(phenylmethyl)piperidin-4-yl]sulfanyl-1H-indole

Systemtic Name: 5-bromanyl-3-[1-(phenylmethyl)piperidin-4-yl]sulfanyl-1H-indole Openeye Name: 3-[(1-benzyl-4-piperidyl)sulfanyl]-5-bromo-1H-indole CAS Name: 5-bromo-3-[[1-(phenylmethyl)-4-piperidinyl]thio]-1H-indole IUPAC Name: 3-(1-benzylpiperidin-4-yl)sulfanyl-5-bromo-1H-indole Traditional Name: 3-[(1-benzyl-4-piperidyl)thio]-5-bromo-1H-indole Formula: C20H21BrN2S MolecularWeight: 401.36314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1SC2=CNC3=C2C=C(C=C3)Br)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1SC2=CNC3=C2C=C(C=C3)Br)CC4=CC=CC=C4

InChI

InChI=1S/C20H21BrN2S/c21-16-6-7-19-18(12-16)20(13-22-19)24-17-8-10-23(11-9-17)14-15-4-2-1-3-5-15/h1-7,12-13,17,22H,8-11,14H2