N-(4-fluoranyl-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-(4-fluoranyl-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-N-(2-pyridinylmethyl)-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)-2-(2-thienyl)cinchoninamide Formula: C27H17FN4OS2 MolecularWeight: 496.578483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)N(CC4=CC=CC=N4)C5=NC6=C(C=CC=C6S5)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)N(CC4=CC=CC=N4)C5=NC6=C(C=CC=C6S5)F

InChI

InChI=1S/C27H17FN4OS2/c28-20-9-5-11-24-25(20)31-27(35-24)32(16-17-7-3-4-13-29-17)26(33)19-15-22(23-12-6-14-34-23)30-21-10-2-1-8-18(19)21/h1-15H,16H2