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

Systemtic Name: 3-bromanyl-N-[[4-(tert-butylsulfamoyl)phenyl]carbamothioyl]-4-hexoxy-benzamide Openeye Name: 3-bromo-N-[[4-(tert-butylsulfamoyl)phenyl]carbamothioyl]-4-hexoxy-benzamide CAS Name: 3-bromo-N-[[4-(tert-butylsulfamoyl)anilino]-sulfanylidenemethyl]-4-hexoxybenzamide IUPAC Name: 3-bromo-N-[[4-(tert-butylsulfamoyl)phenyl]carbamothioyl]-4-hexoxybenzamide Traditional Name: 3-bromo-N-[[4-(tert-butylsulfamoyl)phenyl]thiocarbamoyl]-4-hexoxy-benzamide Formula: C24H32BrN3O4S2 MolecularWeight: 570.56258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC(C)(C)C)Br

Isomeric SMILES

CCCCCCOC1=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/C24H32BrN3O4S2/c1-5-6-7-8-15-32-21-14-9-17(16-20(21)25)22(29)27-23(33)26-18-10-12-19(13-11-18)34(30,31)28-24(2,3)4/h9-14,16,28H,5-8,15H2,1-4H3,(H2,26,27,29,33)