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

Systemtic Name: 5-bromanyl-2-phenethyloxy-N-[[4-(propylsulfamoyl)phenyl]carbamothioyl]benzamide Openeye Name: 5-bromo-2-phenethyloxy-N-[[4-(propylsulfamoyl)phenyl]carbamothioyl]benzamide CAS Name: 5-bromo-2-phenethyloxy-N-[[4-(propylsulfamoyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-phenethyloxy-N-[[4-(propylsulfamoyl)phenyl]carbamothioyl]benzamide Traditional Name: 5-bromo-2-phenethyloxy-N-[[4-(propylsulfamoyl)phenyl]thiocarbamoyl]benzamide Formula: C25H26BrN3O4S2 MolecularWeight: 576.52564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26BrN3O4S2/c1-2-15-27-35(31,32)21-11-9-20(10-12-21)28-25(34)29-24(30)22-17-19(26)8-13-23(22)33-16-14-18-6-4-3-5-7-18/h3-13,17,27H,2,14-16H2,1H3,(H2,28,29,30,34)