4-(2-cyanoethylsulfamoyl)-N-[4-methyl-3-(phenylsulfonylamino)phenyl]benzamide

Systemtic Name: 4-(2-cyanoethylsulfamoyl)-N-[4-methyl-3-(phenylsulfonylamino)phenyl]benzamide Openeye Name: N-[3-(benzenesulfonamido)-4-methyl-phenyl]-4-(2-cyanoethylsulfamoyl)benzamide CAS Name: N-[3-(benzenesulfonamido)-4-methylphenyl]-4-(2-cyanoethylsulfamoyl)benzamide IUPAC Name: N-[3-(benzenesulfonamido)-4-methylphenyl]-4-(2-cyanoethylsulfamoyl)benzamide Traditional Name: N-[3-(benzenesulfonamido)-4-methyl-phenyl]-4-(2-cyanoethylsulfamoyl)benzamide Formula: C23H22N4O5S2 MolecularWeight: 498.57458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC#N)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC#N)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H22N4O5S2/c1-17-8-11-19(16-22(17)27-34(31,32)20-6-3-2-4-7-20)26-23(28)18-9-12-21(13-10-18)33(29,30)25-15-5-14-24/h2-4,6-13,16,25,27H,5,15H2,1H3,(H,26,28)