1-(2,3-dihydroindol-1-yl)-2-[3-(phenylmethyl)sulfonylindol-1-yl]ethanone

Systemtic Name: 1-(2,3-dihydroindol-1-yl)-2-[3-(phenylmethyl)sulfonylindol-1-yl]ethanone Openeye Name: 2-(3-benzylsulfonylindol-1-yl)-1-indolin-1-yl-ethanone CAS Name: 1-(2,3-dihydroindol-1-yl)-2-[3-(phenylmethyl)sulfonyl-1-indolyl]ethanone IUPAC Name: 2-(3-benzylsulfonylindol-1-yl)-1-(2,3-dihydroindol-1-yl)ethanone Traditional Name: 2-(3-benzylsulfonylindol-1-yl)-1-indolin-1-yl-ethanone Formula: C25H22N2O3S MolecularWeight: 430.51878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)C(=O)CN3C=C(C4=CC=CC=C43)S(=O)(=O)CC5=CC=CC=C5

Isomeric SMILES

C1CN(C2=CC=CC=C21)C(=O)CN3C=C(C4=CC=CC=C43)S(=O)(=O)CC5=CC=CC=C5

InChI

InChI=1S/C25H22N2O3S/c28-25(27-15-14-20-10-4-6-12-22(20)27)17-26-16-24(21-11-5-7-13-23(21)26)31(29,30)18-19-8-2-1-3-9-19/h1-13,16H,14-15,17-18H2