3-bromanyl-4-butoxy-N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-butoxy-N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]benzamide Openeye Name: 3-bromo-4-butoxy-N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]benzamide CAS Name: 3-bromo-4-butoxy-N-[[4-(cyclohexylsulfamoyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-butoxy-N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]benzamide Traditional Name: 3-bromo-4-butoxy-N-[[4-(cyclohexylsulfamoyl)phenyl]thiocarbamoyl]benzamide Formula: C24H30BrN3O4S2 MolecularWeight: 568.5467

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3CCCCC3)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3CCCCC3)Br

InChI

InChI=1S/C24H30BrN3O4S2/c1-2-3-15-32-22-14-9-17(16-21(22)25)23(29)27-24(33)26-18-10-12-20(13-11-18)34(30,31)28-19-7-5-4-6-8-19/h9-14,16,19,28H,2-8,15H2,1H3,(H2,26,27,29,33)