6-bromanyl-2-pyridin-3-yl-N-[(4-sulfamoylphenyl)methyl]quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-2-pyridin-3-yl-N-[(4-sulfamoylphenyl)methyl]quinoline-4-carboxamide Openeye Name: 6-bromo-2-(3-pyridyl)-N-[(4-sulfamoylphenyl)methyl]quinoline-4-carboxamide CAS Name: 6-bromo-2-(3-pyridinyl)-N-[(4-sulfamoylphenyl)methyl]-4-quinolinecarboxamide IUPAC Name: 6-bromo-2-pyridin-3-yl-N-[(4-sulfamoylphenyl)methyl]quinoline-4-carboxamide Traditional Name: 6-bromo-2-(3-pyridyl)-N-(4-sulfamoylbenzyl)cinchoninamide Formula: C22H17BrN4O3S MolecularWeight: 497.36438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CN=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C22H17BrN4O3S/c23-16-5-8-20-18(10-16)19(11-21(27-20)15-2-1-9-25-13-15)22(28)26-12-14-3-6-17(7-4-14)31(24,29)30/h1-11,13H,12H2,(H,26,28)(H2,24,29,30)