3-[[2-(4-bromanylphenoxy)ethanoylamino]carbamoyl]-N-(2,4-dimethylphenyl)benzenesulfonamide

Systemtic Name: 3-[[2-(4-bromanylphenoxy)ethanoylamino]carbamoyl]-N-(2,4-dimethylphenyl)benzenesulfonamide Openeye Name: 3-[[[2-(4-bromophenoxy)acetyl]amino]carbamoyl]-N-(2,4-dimethylphenyl)benzenesulfonamide CAS Name: 3-[[[2-(4-bromophenoxy)-1-oxoethyl]hydrazo]-oxomethyl]-N-(2,4-dimethylphenyl)benzenesulfonamide IUPAC Name: 3-[[[2-(4-bromophenoxy)acetyl]amino]carbamoyl]-N-(2,4-dimethylphenyl)benzenesulfonamide Traditional Name: 3-[[[2-(4-bromophenoxy)acetyl]amino]carbamoyl]-N-(2,4-dimethylphenyl)benzenesulfonamide Formula: C23H22BrN3O5S MolecularWeight: 532.40688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)COC3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)COC3=CC=C(C=C3)Br)C

InChI

InChI=1S/C23H22BrN3O5S/c1-15-6-11-21(16(2)12-15)27-33(30,31)20-5-3-4-17(13-20)23(29)26-25-22(28)14-32-19-9-7-18(24)8-10-19/h3-13,27H,14H2,1-2H3,(H,25,28)(H,26,29)