2-thiophen-2-yl-N-[4,5,6-tris(fluoranyl)-1,3-benzothiazol-2-yl]quinoline-4-carboxamide

Systemtic Name: 2-thiophen-2-yl-N-[4,5,6-tris(fluoranyl)-1,3-benzothiazol-2-yl]quinoline-4-carboxamide Openeye Name: 2-(2-thienyl)-N-(4,5,6-trifluoro-1,3-benzothiazol-2-yl)quinoline-4-carboxamide CAS Name: 2-thiophen-2-yl-N-(4,5,6-trifluoro-1,3-benzothiazol-2-yl)-4-quinolinecarboxamide IUPAC Name: 2-thiophen-2-yl-N-(4,5,6-trifluoro-1,3-benzothiazol-2-yl)quinoline-4-carboxamide Traditional Name: 2-(2-thienyl)-N-(4,5,6-trifluoro-1,3-benzothiazol-2-yl)cinchoninamide Formula: C21H10F3N3OS2 MolecularWeight: 441.44881

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=NC5=C(S4)C=C(C(=C5F)F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=NC5=C(S4)C=C(C(=C5F)F)F

InChI

InChI=1S/C21H10F3N3OS2/c22-12-9-16-19(18(24)17(12)23)26-21(30-16)27-20(28)11-8-14(15-6-3-7-29-15)25-13-5-2-1-4-10(11)13/h1-9H,(H,26,27,28)