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

Systemtic Name: 5-bromanyl-N-[[4-(tert-butylsulfamoyl)phenyl]carbamothioyl]-2-ethoxy-benzamide Openeye Name: 5-bromo-N-[[4-(tert-butylsulfamoyl)phenyl]carbamothioyl]-2-ethoxy-benzamide CAS Name: 5-bromo-N-[[4-(tert-butylsulfamoyl)anilino]-sulfanylidenemethyl]-2-ethoxybenzamide IUPAC Name: 5-bromo-N-[[4-(tert-butylsulfamoyl)phenyl]carbamothioyl]-2-ethoxybenzamide Traditional Name: 5-bromo-N-[[4-(tert-butylsulfamoyl)phenyl]thiocarbamoyl]-2-ethoxy-benzamide Formula: C20H24BrN3O4S2 MolecularWeight: 514.45626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24BrN3O4S2/c1-5-28-17-11-6-13(21)12-16(17)18(25)23-19(29)22-14-7-9-15(10-8-14)30(26,27)24-20(2,3)4/h6-12,24H,5H2,1-4H3,(H2,22,23,25,29)