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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=C(S1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

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