N-butan-2-yl-2-[2-[(4-ethoxy-2-methylsulfonyl-phenyl)amino]ethanoylamino]benzamide

Systemtic Name: N-butan-2-yl-2-[2-[(4-ethoxy-2-methylsulfonyl-phenyl)amino]ethanoylamino]benzamide Openeye Name: 2-[[2-(4-ethoxy-2-methylsulfonyl-anilino)acetyl]amino]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-2-[[2-(4-ethoxy-2-methylsulfonylanilino)-1-oxoethyl]amino]benzamide IUPAC Name: N-butan-2-yl-2-[[2-(4-ethoxy-2-methylsulfonylanilino)acetyl]amino]benzamide Traditional Name: 2-[[2-(4-ethoxy-2-mesyl-anilino)acetyl]amino]-N-sec-butyl-benzamide Formula: C22H29N3O5S MolecularWeight: 447.54776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=CC=C1NC(=O)CNC2=C(C=C(C=C2)OCC)S(=O)(=O)C

Isomeric SMILES

CCC(C)NC(=O)C1=CC=CC=C1NC(=O)CNC2=C(C=C(C=C2)OCC)S(=O)(=O)C

InChI

InChI=1S/C22H29N3O5S/c1-5-15(3)24-22(27)17-9-7-8-10-18(17)25-21(26)14-23-19-12-11-16(30-6-2)13-20(19)31(4,28)29/h7-13,15,23H,5-6,14H2,1-4H3,(H,24,27)(H,25,26)