2-[2-[2,5-bis(oxidanylidene)-3-(phenylmethyl)piperazin-1-yl]ethanoylamino]-N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-3-(1H-indol-3-yl)propanamide

Systemtic Name: 2-[2-[2,5-bis(oxidanylidene)-3-(phenylmethyl)piperazin-1-yl]ethanoylamino]-N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-3-(1H-indol-3-yl)propanamide Openeye Name: 2-[[2-(3-benzyl-2,5-dioxo-piperazin-1-yl)acetyl]amino]-N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-3-(1H-indol-3-yl)propanamide CAS Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-2-[[2-[2,5-dioxo-3-(phenylmethyl)-1-piperazinyl]-1-oxoethyl]amino]-3-(1H-indol-3-yl)propanamide IUPAC Name: 2-[[2-(3-benzyl-2,5-dioxopiperazin-1-yl)acetyl]amino]-N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-3-(1H-indol-3-yl)propanamide Traditional Name: 2-[[2-(3-benzyl-2,5-diketo-piperazino)acetyl]amino]-N-[3,5-bis(trifluoromethyl)benzyl]-3-(1H-indol-3-yl)propionamide Formula: C33H29F6N5O4 MolecularWeight: 673.604879

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC(C(=O)N1CC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)NCC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F)CC5=CC=CC=C5

Isomeric SMILES

C1C(=O)NC(C(=O)N1CC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)NCC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F)CC5=CC=CC=C5

InChI

InChI=1S/C33H29F6N5O4/c34-32(35,36)22-10-20(11-23(14-22)33(37,38)39)15-41-30(47)26(13-21-16-40-25-9-5-4-8-24(21)25)42-28(45)17-44-18-29(46)43-27(31(44)48)12-19-6-2-1-3-7-19/h1-11,14,16,26-27,40H,12-13,15,17-18H2,(H,41,47)(H,42,45)(H,43,46)