N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-[(2-bromophenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-[(2-bromophenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-2-(2-bromo-N-methylsulfonyl-anilino)acetamide CAS Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(2-bromo-N-methylsulfonylanilino)acetamide IUPAC Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(2-bromo-N-methylsulfonylanilino)acetamide Traditional Name: 2-(2-bromo-N-mesyl-anilino)-N-[(E)-piperonylideneamino]acetamide Formula: C17H16BrN3O5S MolecularWeight: 454.29504

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NN=CC1=CC2=C(C=C1)OCO2)C3=CC=CC=C3Br

Isomeric SMILES

CS(=O)(=O)N(CC(=O)N/N=C/C1=CC2=C(C=C1)OCO2)C3=CC=CC=C3Br

InChI

InChI=1S/C17H16BrN3O5S/c1-27(23,24)21(14-5-3-2-4-13(14)18)10-17(22)20-19-9-12-6-7-15-16(8-12)26-11-25-15/h2-9H,10-11H2,1H3,(H,20,22)/b19-9+