dimethyl 5-[(1-ethyl-6-phenyl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(1-ethyl-6-phenyl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(1-ethyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[[(1-ethyl-6-phenyl-4-pyrazolo[3,4-b]pyridinyl)-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(1-ethyl-6-phenylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(1-ethyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C25H22N4O5 MolecularWeight: 458.46598

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CC=C3)C(=O)NC4=CC(=CC(=C4)C(=O)OC)C(=O)OC

Isomeric SMILES

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CC=C3)C(=O)NC4=CC(=CC(=C4)C(=O)OC)C(=O)OC

InChI

InChI=1S/C25H22N4O5/c1-4-29-22-20(14-26-29)19(13-21(28-22)15-8-6-5-7-9-15)23(30)27-18-11-16(24(31)33-2)10-17(12-18)25(32)34-3/h5-14H,4H2,1-3H3,(H,27,30)