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

Systemtic Name: 5-bromanyl-N-[[4-(dipropylsulfamoyl)phenyl]carbamothioyl]-2-phenethyloxy-benzamide Openeye Name: 5-bromo-N-[[4-(dipropylsulfamoyl)phenyl]carbamothioyl]-2-phenethyloxy-benzamide CAS Name: 5-bromo-N-[[4-(dipropylsulfamoyl)anilino]-sulfanylidenemethyl]-2-phenethyloxybenzamide IUPAC Name: 5-bromo-N-[[4-(dipropylsulfamoyl)phenyl]carbamothioyl]-2-phenethyloxybenzamide Traditional Name: 5-bromo-N-[[4-(dipropylsulfamoyl)phenyl]thiocarbamoyl]-2-phenethyloxy-benzamide Formula: C28H32BrN3O4S2 MolecularWeight: 618.60538

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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)OCCC3=CC=CC=C3

Isomeric SMILES

CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3

InChI

InChI=1S/C28H32BrN3O4S2/c1-3-17-32(18-4-2)38(34,35)24-13-11-23(12-14-24)30-28(37)31-27(33)25-20-22(29)10-15-26(25)36-19-16-21-8-6-5-7-9-21/h5-15,20H,3-4,16-19H2,1-2H3,(H2,30,31,33,37)