N-[1-cyano-3-(1H-indol-3-yl)propan-2-yl]-5-(4-pyrrolidin-1-ylcarbonylphenyl)-2-(trifluoromethyloxy)benzamide

Systemtic Name: N-[1-cyano-3-(1H-indol-3-yl)propan-2-yl]-5-(4-pyrrolidin-1-ylcarbonylphenyl)-2-(trifluoromethyloxy)benzamide Openeye Name: N-[1-(cyanomethyl)-2-(1H-indol-3-yl)ethyl]-5-[4-(pyrrolidine-1-carbonyl)phenyl]-2-(trifluoromethoxy)benzamide CAS Name: N-[1-cyano-3-(1H-indol-3-yl)propan-2-yl]-5-[4-[oxo(1-pyrrolidinyl)methyl]phenyl]-2-(trifluoromethoxy)benzamide IUPAC Name: N-[1-cyano-3-(1H-indol-3-yl)propan-2-yl]-5-[4-(pyrrolidine-1-carbonyl)phenyl]-2-(trifluoromethoxy)benzamide Traditional Name: N-[1-(cyanomethyl)-2-(1H-indol-3-yl)ethyl]-5-[4-(pyrrolidine-1-carbonyl)phenyl]-2-(trifluoromethoxy)benzamide Formula: C31H27F3N4O3 MolecularWeight: 560.56629

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)C3=CC(=C(C=C3)OC(F)(F)F)C(=O)NC(CC#N)CC4=CNC5=CC=CC=C54

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)C3=CC(=C(C=C3)OC(F)(F)F)C(=O)NC(CC#N)CC4=CNC5=CC=CC=C54

InChI

InChI=1S/C31H27F3N4O3/c32-31(33,34)41-28-12-11-22(20-7-9-21(10-8-20)30(40)38-15-3-4-16-38)18-26(28)29(39)37-24(13-14-35)17-23-19-36-27-6-2-1-5-25(23)27/h1-2,5-12,18-19,24,36H,3-4,13,15-17H2,(H,37,39)