methyl 2-[2-(3,4-dimethyl-7-oxidanylidene-2-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)propanoylamino]benzoate

Systemtic Name: methyl 2-[2-(3,4-dimethyl-7-oxidanylidene-2-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)propanoylamino]benzoate Openeye Name: methyl 2-[2-(3,4-dimethyl-7-oxo-2-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)propanoylamino]benzoate CAS Name: 2-[[2-(3,4-dimethyl-7-oxo-2-phenyl-6-pyrazolo[3,4-d]pyridazinyl)-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[2-(3,4-dimethyl-7-oxo-2-phenylpyrazolo[3,4-d]pyridazin-6-yl)propanoylamino]benzoate Traditional Name: 2-[2-(7-keto-3,4-dimethyl-2-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)propanoylamino]benzoic acid methyl ester Formula: C24H23N5O4 MolecularWeight: 445.47052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NN(C(=O)C2=NN1C3=CC=CC=C3)C(C)C(=O)NC4=CC=CC=C4C(=O)OC)C

Isomeric SMILES

CC1=C2C(=NN(C(=O)C2=NN1C3=CC=CC=C3)C(C)C(=O)NC4=CC=CC=C4C(=O)OC)C

InChI

InChI=1S/C24H23N5O4/c1-14-20-15(2)28(17-10-6-5-7-11-17)27-21(20)23(31)29(26-14)16(3)22(30)25-19-13-9-8-12-18(19)24(32)33-4/h5-13,16H,1-4H3,(H,25,30)