3-iodanyl-4-methyl-N-[[4-(phenethylsulfamoyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-iodanyl-4-methyl-N-[[4-(phenethylsulfamoyl)phenyl]carbamothioyl]benzamide Openeye Name: 3-iodo-4-methyl-N-[[4-(phenethylsulfamoyl)phenyl]carbamothioyl]benzamide CAS Name: 3-iodo-4-methyl-N-[[4-(phenethylsulfamoyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-iodo-4-methyl-N-[[4-(phenethylsulfamoyl)phenyl]carbamothioyl]benzamide Traditional Name: 3-iodo-4-methyl-N-[[4-(phenethylsulfamoyl)phenyl]thiocarbamoyl]benzamide Formula: C23H22IN3O3S2 MolecularWeight: 579.47355

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NCCC3=CC=CC=C3)I

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NCCC3=CC=CC=C3)I

InChI

InChI=1S/C23H22IN3O3S2/c1-16-7-8-18(15-21(16)24)22(28)27-23(31)26-19-9-11-20(12-10-19)32(29,30)25-14-13-17-5-3-2-4-6-17/h2-12,15,25H,13-14H2,1H3,(H2,26,27,28,31)