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

Systemtic Name: 5-bromanyl-N-[[4-(tert-butylsulfamoyl)phenyl]carbamothioyl]-2-methoxy-benzamide Openeye Name: 5-bromo-N-[[4-(tert-butylsulfamoyl)phenyl]carbamothioyl]-2-methoxy-benzamide CAS Name: 5-bromo-N-[[4-(tert-butylsulfamoyl)anilino]-sulfanylidenemethyl]-2-methoxybenzamide IUPAC Name: 5-bromo-N-[[4-(tert-butylsulfamoyl)phenyl]carbamothioyl]-2-methoxybenzamide Traditional Name: 5-bromo-N-[[4-(tert-butylsulfamoyl)phenyl]thiocarbamoyl]-2-methoxy-benzamide Formula: C19H22BrN3O4S2 MolecularWeight: 500.42968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C19H22BrN3O4S2/c1-19(2,3)23-29(25,26)14-8-6-13(7-9-14)21-18(28)22-17(24)15-11-12(20)5-10-16(15)27-4/h5-11,23H,1-4H3,(H2,21,22,24,28)