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

Systemtic Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-2-(2-pyridyl)cinchoninamide Formula: C23H16N4OS2 MolecularWeight: 428.52934

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=N5

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=N5

InChI

InChI=1S/C23H16N4OS2/c1-29-23-27-19-10-9-14(12-21(19)30-23)25-22(28)16-13-20(18-8-4-5-11-24-18)26-17-7-3-2-6-15(16)17/h2-13H,1H3,(H,25,28)