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

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-2-(3-pyridyl)cinchoninamide Formula: C23H16N4O3S2 MolecularWeight: 460.52814

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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=CN=CC=C5

Isomeric SMILES

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

InChI

InChI=1S/C23H16N4O3S2/c1-32(29,30)15-8-9-19-21(11-15)31-23(26-19)27-22(28)17-12-20(14-5-4-10-24-13-14)25-18-7-3-2-6-16(17)18/h2-13H,1H3,(H,26,27,28)