N-[3-(2-thiophen-2-ylethynyl)phenyl]-2-(2,3,4-trimethoxyphenyl)ethanamide

Systemtic Name: N-[3-(2-thiophen-2-ylethynyl)phenyl]-2-(2,3,4-trimethoxyphenyl)ethanamide Openeye Name: N-[3-[2-(2-thienyl)ethynyl]phenyl]-2-(2,3,4-trimethoxyphenyl)acetamide CAS Name: N-[3-(2-thiophen-2-ylethynyl)phenyl]-2-(2,3,4-trimethoxyphenyl)acetamide IUPAC Name: N-[3-(2-thiophen-2-ylethynyl)phenyl]-2-(2,3,4-trimethoxyphenyl)acetamide Traditional Name: N-[3-[2-(2-thienyl)ethynyl]phenyl]-2-(2,3,4-trimethoxyphenyl)acetamide Formula: C23H21NO4S MolecularWeight: 407.48214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CC(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CC(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3)OC)OC

InChI

InChI=1S/C23H21NO4S/c1-26-20-12-10-17(22(27-2)23(20)28-3)15-21(25)24-18-7-4-6-16(14-18)9-11-19-8-5-13-29-19/h4-8,10,12-14H,15H2,1-3H3,(H,24,25)