2-(4-bromophenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)quinoline-4-carboxamide

Systemtic Name: 2-(4-bromophenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)quinoline-4-carboxamide Openeye Name: 2-(4-bromophenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)quinoline-4-carboxamide CAS Name: 2-(4-bromophenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-quinolinecarboxamide IUPAC Name: 2-(4-bromophenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)quinoline-4-carboxamide Traditional Name: 2-(4-bromophenyl)-N-(6-mesyl-1,3-benzothiazol-2-yl)cinchoninamide Formula: C24H16BrN3O3S2 MolecularWeight: 538.43614

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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(=NC4=CC=CC=C43)C5=CC=C(C=C5)Br

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)Br

InChI

InChI=1S/C24H16BrN3O3S2/c1-33(30,31)16-10-11-20-22(12-16)32-24(27-20)28-23(29)18-13-21(14-6-8-15(25)9-7-14)26-19-5-3-2-4-17(18)19/h2-13H,1H3,(H,27,28,29)