2-[phenethyl-(2,4,6-trimethylphenyl)sulfonyl-amino]-N-[(4-sulfamoylphenyl)methyl]ethanamide

Systemtic Name: 2-[phenethyl-(2,4,6-trimethylphenyl)sulfonyl-amino]-N-[(4-sulfamoylphenyl)methyl]ethanamide Openeye Name: 2-[phenethyl-(2,4,6-trimethylphenyl)sulfonyl-amino]-N-[(4-sulfamoylphenyl)methyl]acetamide CAS Name: 2-[phenethyl-(2,4,6-trimethylphenyl)sulfonylamino]-N-[(4-sulfamoylphenyl)methyl]acetamide IUPAC Name: 2-[phenethyl-(2,4,6-trimethylphenyl)sulfonylamino]-N-[(4-sulfamoylphenyl)methyl]acetamide Traditional Name: 2-[mesitylsulfonyl(phenethyl)amino]-N-(4-sulfamoylbenzyl)acetamide Formula: C26H31N3O5S2 MolecularWeight: 529.67144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(CCC2=CC=CC=C2)CC(=O)NCC3=CC=C(C=C3)S(=O)(=O)N)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(CCC2=CC=CC=C2)CC(=O)NCC3=CC=C(C=C3)S(=O)(=O)N)C

InChI

InChI=1S/C26H31N3O5S2/c1-19-15-20(2)26(21(3)16-19)36(33,34)29(14-13-22-7-5-4-6-8-22)18-25(30)28-17-23-9-11-24(12-10-23)35(27,31)32/h4-12,15-16H,13-14,17-18H2,1-3H3,(H,28,30)(H2,27,31,32)