3-bromanyl-4-(2-methylpropoxy)-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-(2-methylpropoxy)-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide Openeye Name: 3-bromo-4-isobutoxy-N-[[4-(isopropylsulfamoyl)phenyl]carbamothioyl]benzamide CAS Name: 3-bromo-4-(2-methylpropoxy)-N-[[4-(propan-2-ylsulfamoyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-(2-methylpropoxy)-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide Traditional Name: 3-bromo-4-isobutoxy-N-[[4-(isopropylsulfamoyl)phenyl]thiocarbamoyl]benzamide Formula: C21H26BrN3O4S2 MolecularWeight: 528.48284

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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)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)Br

InChI

InChI=1S/C21H26BrN3O4S2/c1-13(2)12-29-19-10-5-15(11-18(19)22)20(26)24-21(30)23-16-6-8-17(9-7-16)31(27,28)25-14(3)4/h5-11,13-14,25H,12H2,1-4H3,(H2,23,24,26,30)