[6-bromanyl-5-methoxy-1-methyl-2-(phenylsulfanylmethyl)indol-3-yl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [6-bromanyl-5-methoxy-1-methyl-2-(phenylsulfanylmethyl)indol-3-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [6-bromo-5-methoxy-1-methyl-2-(phenylsulfanylmethyl)indol-3-yl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [6-bromo-5-methoxy-1-methyl-2-[(phenylthio)methyl]-3-indolyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [6-bromo-5-methoxy-1-methyl-2-(phenylsulfanylmethyl)indol-3-yl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [6-bromo-5-methoxy-1-methyl-2-[(phenylthio)methyl]indol-3-yl]-(4-phenylpiperazino)methanone Formula: C28H28BrN3O2S MolecularWeight: 550.50982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC(=C(C=C2C(=C1CSC3=CC=CC=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5)OC)Br

Isomeric SMILES

CN1C2=CC(=C(C=C2C(=C1CSC3=CC=CC=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5)OC)Br

InChI

InChI=1S/C28H28BrN3O2S/c1-30-24-18-23(29)26(34-2)17-22(24)27(25(30)19-35-21-11-7-4-8-12-21)28(33)32-15-13-31(14-16-32)20-9-5-3-6-10-20/h3-12,17-18H,13-16,19H2,1-2H3