N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-[(4-ethoxyphenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]ethanamide

Systemtic Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-[(4-ethoxyphenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]ethanamide Openeye Name: N-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-2-(4-ethoxy-N-(4-methylsulfanylphenyl)sulfonyl-anilino)acetamide CAS Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(4-ethoxy-N-[4-(methylthio)phenyl]sulfonylanilino)acetamide IUPAC Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(4-ethoxy-N-(4-methylsulfanylphenyl)sulfonylanilino)acetamide Traditional Name: 2-(4-ethoxy-N-[4-(methylthio)phenyl]sulfonyl-anilino)-N-[(E)-piperonylideneamino]acetamide Formula: C25H25N3O6S2 MolecularWeight: 527.6125

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CC(=O)NN=CC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C=C4)SC

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CC(=O)N/N=C/C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C=C4)SC

InChI

InChI=1S/C25H25N3O6S2/c1-3-32-20-7-5-19(6-8-20)28(36(30,31)22-11-9-21(35-2)10-12-22)16-25(29)27-26-15-18-4-13-23-24(14-18)34-17-33-23/h4-15H,3,16-17H2,1-2H3,(H,27,29)/b26-15+