5-bromanyl-N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]-2-phenethyloxy-benzamide

Systemtic Name: 5-bromanyl-N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]-2-phenethyloxy-benzamide Openeye Name: 5-bromo-N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]-2-phenethyloxy-benzamide CAS Name: 5-bromo-N-[[4-(cyclohexylsulfamoyl)anilino]-sulfanylidenemethyl]-2-phenethyloxybenzamide IUPAC Name: 5-bromo-N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]-2-phenethyloxybenzamide Traditional Name: 5-bromo-N-[[4-(cyclohexylsulfamoyl)phenyl]thiocarbamoyl]-2-phenethyloxy-benzamide Formula: C28H30BrN3O4S2 MolecularWeight: 616.5895

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=C(C=CC(=C3)Br)OCCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=C(C=CC(=C3)Br)OCCC4=CC=CC=C4

InChI

InChI=1S/C28H30BrN3O4S2/c29-21-11-16-26(36-18-17-20-7-3-1-4-8-20)25(19-21)27(33)31-28(37)30-22-12-14-24(15-13-22)38(34,35)32-23-9-5-2-6-10-23/h1,3-4,7-8,11-16,19,23,32H,2,5-6,9-10,17-18H2,(H2,30,31,33,37)