ethyl 3-[2-(5,7-dimethyl-4-oxidanylidene-3-phenyl-pyrrolo[3,4-d]pyridazin-6-yl)propanoylamino]benzoate

Systemtic Name: ethyl 3-[2-(5,7-dimethyl-4-oxidanylidene-3-phenyl-pyrrolo[3,4-d]pyridazin-6-yl)propanoylamino]benzoate Openeye Name: ethyl 3-[2-(5,7-dimethyl-4-oxo-3-phenyl-pyrrolo[3,4-d]pyridazin-6-yl)propanoylamino]benzoate CAS Name: 3-[[2-(5,7-dimethyl-4-oxo-3-phenyl-6-pyrrolo[3,4-d]pyridazinyl)-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[2-(5,7-dimethyl-4-oxo-3-phenylpyrrolo[3,4-d]pyridazin-6-yl)propanoylamino]benzoate Traditional Name: 3-[2-(4-keto-5,7-dimethyl-3-phenyl-pyrrolo[3,4-d]pyridazin-6-yl)propanoylamino]benzoic acid ethyl ester Formula: C26H26N4O4 MolecularWeight: 458.50904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C(C)N2C(=C3C=NN(C(=O)C3=C2C)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)C(C)N2C(=C3C=NN(C(=O)C3=C2C)C4=CC=CC=C4)C

InChI

InChI=1S/C26H26N4O4/c1-5-34-26(33)19-10-9-11-20(14-19)28-24(31)18(4)29-16(2)22-15-27-30(21-12-7-6-8-13-21)25(32)23(22)17(29)3/h6-15,18H,5H2,1-4H3,(H,28,31)