N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-[(4-methylphenyl)sulfonyl-quinolin-8-yl-amino]ethanamide

Systemtic Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-[(4-methylphenyl)sulfonyl-quinolin-8-yl-amino]ethanamide Openeye Name: N-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-2-[p-tolylsulfonyl(8-quinolyl)amino]acetamide CAS Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-[(4-methylphenyl)sulfonyl-(8-quinolinyl)amino]acetamide IUPAC Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-[(4-methylphenyl)sulfonyl-quinolin-8-ylamino]acetamide Traditional Name: N-[(E)-piperonylideneamino]-2-[8-quinolyl(tosyl)amino]acetamide Formula: C26H22N4O5S MolecularWeight: 502.54168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NN=CC2=CC3=C(C=C2)OCO3)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N/N=C/C2=CC3=C(C=C2)OCO3)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C26H22N4O5S/c1-18-7-10-21(11-8-18)36(32,33)30(22-6-2-4-20-5-3-13-27-26(20)22)16-25(31)29-28-15-19-9-12-23-24(14-19)35-17-34-23/h2-15H,16-17H2,1H3,(H,29,31)/b28-15+