5-bromanyl-N-[[4-(dipropylsulfamoyl)phenyl]carbamothioyl]-2-ethoxy-benzamide

Systemtic Name: 5-bromanyl-N-[[4-(dipropylsulfamoyl)phenyl]carbamothioyl]-2-ethoxy-benzamide Openeye Name: 5-bromo-N-[[4-(dipropylsulfamoyl)phenyl]carbamothioyl]-2-ethoxy-benzamide CAS Name: 5-bromo-N-[[4-(dipropylsulfamoyl)anilino]-sulfanylidenemethyl]-2-ethoxybenzamide IUPAC Name: 5-bromo-N-[[4-(dipropylsulfamoyl)phenyl]carbamothioyl]-2-ethoxybenzamide Traditional Name: 5-bromo-N-[[4-(dipropylsulfamoyl)phenyl]thiocarbamoyl]-2-ethoxy-benzamide Formula: C22H28BrN3O4S2 MolecularWeight: 542.50942

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCC

Isomeric SMILES

CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCC

InChI

InChI=1S/C22H28BrN3O4S2/c1-4-13-26(14-5-2)32(28,29)18-10-8-17(9-11-18)24-22(31)25-21(27)19-15-16(23)7-12-20(19)30-6-3/h7-12,15H,4-6,13-14H2,1-3H3,(H2,24,25,27,31)