3-bromanyl-N-[[4-(tert-butylsulfamoyl)phenyl]carbamothioyl]-4-(2-methylpropoxy)benzamide

Systemtic Name: 3-bromanyl-N-[[4-(tert-butylsulfamoyl)phenyl]carbamothioyl]-4-(2-methylpropoxy)benzamide Openeye Name: 3-bromo-N-[[4-(tert-butylsulfamoyl)phenyl]carbamothioyl]-4-isobutoxy-benzamide CAS Name: 3-bromo-N-[[4-(tert-butylsulfamoyl)anilino]-sulfanylidenemethyl]-4-(2-methylpropoxy)benzamide IUPAC Name: 3-bromo-N-[[4-(tert-butylsulfamoyl)phenyl]carbamothioyl]-4-(2-methylpropoxy)benzamide Traditional Name: 3-bromo-N-[[4-(tert-butylsulfamoyl)phenyl]thiocarbamoyl]-4-isobutoxy-benzamide Formula: C22H28BrN3O4S2 MolecularWeight: 542.50942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC(C)(C)C)Br

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC(C)(C)C)Br

InChI

InChI=1S/C22H28BrN3O4S2/c1-14(2)13-30-19-11-6-15(12-18(19)23)20(27)25-21(31)24-16-7-9-17(10-8-16)32(28,29)26-22(3,4)5/h6-12,14,26H,13H2,1-5H3,(H2,24,25,27,31)