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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-piperonyl-2-(2-thienyl)cinchoninamide Formula: C22H16N2O3S MolecularWeight: 388.43904

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C22H16N2O3S/c25-22(23-12-14-7-8-19-20(10-14)27-13-26-19)16-11-18(21-6-3-9-28-21)24-17-5-2-1-4-15(16)17/h1-11H,12-13H2,(H,23,25)