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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-methyl-N-piperonyl-2-(2-thienyl)cinchoninamide Formula: C23H18N2O3S MolecularWeight: 402.46562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCO2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCO2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C23H18N2O3S/c1-25(13-15-8-9-20-21(11-15)28-14-27-20)23(26)17-12-19(22-7-4-10-29-22)24-18-6-3-2-5-16(17)18/h2-12H,13-14H2,1H3