3-bromanyl-4-ethoxy-N-[[4-(phenylsulfamoyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-N-[[4-(phenylsulfamoyl)phenyl]carbamothioyl]benzamide Openeye Name: 3-bromo-4-ethoxy-N-[[4-(phenylsulfamoyl)phenyl]carbamothioyl]benzamide CAS Name: 3-bromo-4-ethoxy-N-[[4-(phenylsulfamoyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-N-[[4-(phenylsulfamoyl)phenyl]carbamothioyl]benzamide Traditional Name: 3-bromo-4-ethoxy-N-[[4-(phenylsulfamoyl)phenyl]thiocarbamoyl]benzamide Formula: C22H20BrN3O4S2 MolecularWeight: 534.4459

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)Br

InChI

InChI=1S/C22H20BrN3O4S2/c1-2-30-20-13-8-15(14-19(20)23)21(27)25-22(31)24-16-9-11-18(12-10-16)32(28,29)26-17-6-4-3-5-7-17/h3-14,26H,2H2,1H3,(H2,24,25,27,31)