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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-6-methyl-2-thiophen-3-yl-quinoline-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-6-methyl-2-(3-thienyl)quinoline-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-6-methyl-2-(3-thiophenyl)-4-quinolinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-6-methyl-2-thiophen-3-ylquinoline-4-carboxamide Traditional Name: 6-methyl-N-piperonyl-2-(3-thienyl)cinchoninamide Formula: C23H18N2O3S MolecularWeight: 402.46562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NCC3=CC4=C(C=C3)OCO4)C5=CSC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NCC3=CC4=C(C=C3)OCO4)C5=CSC=C5

InChI

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