N-(1,3-benzodioxol-5-ylmethyl)-6-fluoranyl-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-6-fluoranyl-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-6-fluoro-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-6-fluoro-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-6-fluoro-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: 6-fluoro-N-piperonyl-2-(2-thienyl)cinchoninamide Formula: C22H15FN2O3S MolecularWeight: 406.429503

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC(=NC4=C3C=C(C=C4)F)C5=CC=CS5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC(=NC4=C3C=C(C=C4)F)C5=CC=CS5

InChI

InChI=1S/C22H15FN2O3S/c23-14-4-5-17-15(9-14)16(10-18(25-17)21-2-1-7-29-21)22(26)24-11-13-3-6-19-20(8-13)28-12-27-19/h1-10H,11-12H2,(H,24,26)