methyl 2-[(1-ethyl-6-phenyl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]-5-morpholin-4-yl-benzoate

Systemtic Name: methyl 2-[(1-ethyl-6-phenyl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]-5-morpholin-4-yl-benzoate Openeye Name: methyl 2-[(1-ethyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]-5-morpholino-benzoate CAS Name: 2-[[(1-ethyl-6-phenyl-4-pyrazolo[3,4-b]pyridinyl)-oxomethyl]amino]-5-(4-morpholinyl)benzoic acid methyl ester IUPAC Name: methyl 2-[(1-ethyl-6-phenylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]-5-morpholin-4-ylbenzoate Traditional Name: 2-[(1-ethyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]-5-morpholino-benzoic acid methyl ester Formula: C27H27N5O4 MolecularWeight: 485.53438

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CC=C3)C(=O)NC4=C(C=C(C=C4)N5CCOCC5)C(=O)OC

Isomeric SMILES

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CC=C3)C(=O)NC4=C(C=C(C=C4)N5CCOCC5)C(=O)OC

InChI

InChI=1S/C27H27N5O4/c1-3-32-25-22(17-28-32)20(16-24(29-25)18-7-5-4-6-8-18)26(33)30-23-10-9-19(15-21(23)27(34)35-2)31-11-13-36-14-12-31/h4-10,15-17H,3,11-14H2,1-2H3,(H,30,33)