3-bromanyl-N-[[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]-4-methyl-benzamide

Systemtic Name: 3-bromanyl-N-[[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]-4-methyl-benzamide Openeye Name: 3-bromo-N-[[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]-4-methyl-benzamide CAS Name: 3-bromo-N-[[4-[(2,6-dimethylphenyl)sulfamoyl]anilino]-sulfanylidenemethyl]-4-methylbenzamide IUPAC Name: 3-bromo-N-[[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]-4-methylbenzamide Traditional Name: 3-bromo-N-[[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]thiocarbamoyl]-4-methyl-benzamide Formula: C23H22BrN3O3S2 MolecularWeight: 532.47308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=C(C=C3)C)Br

Isomeric SMILES

CC1=C(C(=CC=C1)C)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=C(C=C3)C)Br

InChI

InChI=1S/C23H22BrN3O3S2/c1-14-7-8-17(13-20(14)24)22(28)26-23(31)25-18-9-11-19(12-10-18)32(29,30)27-21-15(2)5-4-6-16(21)3/h4-13,27H,1-3H3,(H2,25,26,28,31)