5-[2-(4-aminocarbonylphenyl)ethynyl]-N-[1-cyano-3-(1H-indol-3-yl)propan-2-yl]-2-propan-2-yloxy-benzamide

Systemtic Name: 5-[2-(4-aminocarbonylphenyl)ethynyl]-N-[1-cyano-3-(1H-indol-3-yl)propan-2-yl]-2-propan-2-yloxy-benzamide Openeye Name: 5-[2-(4-carbamoylphenyl)ethynyl]-N-[1-(cyanomethyl)-2-(1H-indol-3-yl)ethyl]-2-isopropoxy-benzamide CAS Name: 5-[2-(4-carbamoylphenyl)ethynyl]-N-[1-cyano-3-(1H-indol-3-yl)propan-2-yl]-2-propan-2-yloxybenzamide IUPAC Name: 5-[2-(4-carbamoylphenyl)ethynyl]-N-[1-cyano-3-(1H-indol-3-yl)propan-2-yl]-2-propan-2-yloxybenzamide Traditional Name: 5-[2-(4-carbamoylphenyl)ethynyl]-N-[1-(cyanomethyl)-2-(1H-indol-3-yl)ethyl]-2-isopropoxy-benzamide Formula: C31H28N4O3 MolecularWeight: 504.57902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C#CC2=CC=C(C=C2)C(=O)N)C(=O)NC(CC#N)CC3=CNC4=CC=CC=C43

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C#CC2=CC=C(C=C2)C(=O)N)C(=O)NC(CC#N)CC3=CNC4=CC=CC=C43

InChI

InChI=1S/C31H28N4O3/c1-20(2)38-29-14-11-22(8-7-21-9-12-23(13-10-21)30(33)36)17-27(29)31(37)35-25(15-16-32)18-24-19-34-28-6-4-3-5-26(24)28/h3-6,9-14,17,19-20,25,34H,15,18H2,1-2H3,(H2,33,36)(H,35,37)