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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=CC(=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=CC(=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)41-28-11-10-21(20-6-5-7-22(16-20)30(40)38-14-3-4-15-38)18-26(28)29(39)37-24(12-13-35)17-23-19-36-27-9-2-1-8-25(23)27/h1-2,5-11,16,18-19,24,36H,3-4,12,14-15,17H2,(H,37,39)