methyl 4-[2-(4-cyclopropyl-7-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(4-cyclopropyl-7-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(4-cyclopropyl-7-oxo-1-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(4-cyclopropyl-7-oxo-1-phenyl-6-pyrazolo[3,4-d]pyridazinyl)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-cyclopropyl-7-oxo-1-phenylpyrazolo[3,4-d]pyridazin-6-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(4-cyclopropyl-7-keto-1-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)acetyl]amino]benzoic acid methyl ester Formula: C24H21N5O4 MolecularWeight: 443.45464

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=O)C3=C(C=NN3C4=CC=CC=C4)C(=N2)C5CC5

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=O)C3=C(C=NN3C4=CC=CC=C4)C(=N2)C5CC5

InChI

InChI=1S/C24H21N5O4/c1-33-24(32)16-9-11-17(12-10-16)26-20(30)14-28-23(31)22-19(21(27-28)15-7-8-15)13-25-29(22)18-5-3-2-4-6-18/h2-6,9-13,15H,7-8,14H2,1H3,(H,26,30)