1-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-N-(3,4-dimethylphenyl)-6-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: 1-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-N-(3,4-dimethylphenyl)-6-oxidanylidene-pyridazine-3-carboxamide Openeye Name: 1-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl]-N-(3,4-dimethylphenyl)-6-oxo-pyridazine-3-carboxamide CAS Name: 1-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-N-(3,4-dimethylphenyl)-6-oxo-3-pyridazinecarboxamide IUPAC Name: 1-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-N-(3,4-dimethylphenyl)-6-oxopyridazine-3-carboxamide Traditional Name: N-(3,4-dimethylphenyl)-6-keto-1-[2-keto-2-(piperonylamino)ethyl]pyridazine-3-carboxamide Formula: C23H22N4O5 MolecularWeight: 434.44458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=NN(C(=O)C=C2)CC(=O)NCC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=NN(C(=O)C=C2)CC(=O)NCC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C23H22N4O5/c1-14-3-5-17(9-15(14)2)25-23(30)18-6-8-22(29)27(26-18)12-21(28)24-11-16-4-7-19-20(10-16)32-13-31-19/h3-10H,11-13H2,1-2H3,(H,24,28)(H,25,30)