N-(3-ethanoylphenyl)-4-(3-thiophen-2-ylsulfonylpropanoylamino)benzamide

Systemtic Name: N-(3-ethanoylphenyl)-4-(3-thiophen-2-ylsulfonylpropanoylamino)benzamide Openeye Name: N-(3-acetylphenyl)-4-[3-(2-thienylsulfonyl)propanoylamino]benzamide CAS Name: N-(3-acetylphenyl)-4-[(1-oxo-3-thiophen-2-ylsulfonylpropyl)amino]benzamide IUPAC Name: N-(3-acetylphenyl)-4-(3-thiophen-2-ylsulfonylpropanoylamino)benzamide Traditional Name: N-(3-acetylphenyl)-4-[3-(2-thienylsulfonyl)propanoylamino]benzamide Formula: C22H20N2O5S2 MolecularWeight: 456.5346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)NC(=O)CCS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)NC(=O)CCS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C22H20N2O5S2/c1-15(25)17-4-2-5-19(14-17)24-22(27)16-7-9-18(10-8-16)23-20(26)11-13-31(28,29)21-6-3-12-30-21/h2-10,12,14H,11,13H2,1H3,(H,23,26)(H,24,27)