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

Systemtic Name: N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(2-thienyl)cinchoninamide Formula: C23H16N2O4S MolecularWeight: 416.44914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5)OCO2

InChI

InChI=1S/C23H16N2O4S/c1-13(26)15-10-20-21(29-12-28-20)11-18(15)25-23(27)16-9-19(22-7-4-8-30-22)24-17-6-3-2-5-14(16)17/h2-11H,12H2,1H3,(H,25,27)