2-[(4-bromophenyl)sulfonylamino]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 2-[(4-bromophenyl)sulfonylamino]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 2-[(4-bromophenyl)sulfonylamino]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 2-[(4-bromophenyl)sulfonylamino]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 2-[(4-bromophenyl)sulfonylamino]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 2-(brosylamino)-N-(6-mesyl-1,3-benzothiazol-2-yl)benzamide Formula: C21H16BrN3O5S3 MolecularWeight: 566.46784

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H16BrN3O5S3/c1-32(27,28)15-10-11-18-19(12-15)31-21(23-18)24-20(26)16-4-2-3-5-17(16)25-33(29,30)14-8-6-13(22)7-9-14/h2-12,25H,1H3,(H,23,24,26)