N-(3-bromophenyl)-2-[1-(phenylmethyl)-3-phenylsulfanyl-indol-2-yl]ethanamide

Systemtic Name: N-(3-bromophenyl)-2-[1-(phenylmethyl)-3-phenylsulfanyl-indol-2-yl]ethanamide Openeye Name: 2-(1-benzyl-3-phenylsulfanyl-indol-2-yl)-N-(3-bromophenyl)acetamide CAS Name: N-(3-bromophenyl)-2-[1-(phenylmethyl)-3-(phenylthio)-2-indolyl]acetamide IUPAC Name: 2-(1-benzyl-3-phenylsulfanylindol-2-yl)-N-(3-bromophenyl)acetamide Traditional Name: 2-[1-benzyl-3-(phenylthio)indol-2-yl]-N-(3-bromophenyl)acetamide Formula: C29H23BrN2OS MolecularWeight: 527.47472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC=C3C(=C2CC(=O)NC4=CC(=CC=C4)Br)SC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC=C3C(=C2CC(=O)NC4=CC(=CC=C4)Br)SC5=CC=CC=C5

InChI

InChI=1S/C29H23BrN2OS/c30-22-12-9-13-23(18-22)31-28(33)19-27-29(34-24-14-5-2-6-15-24)25-16-7-8-17-26(25)32(27)20-21-10-3-1-4-11-21/h1-18H,19-20H2,(H,31,33)