methyl 5-[(6-cyclopropyl-1,3-dimethyl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]-2-fluoranyl-benzoate

Systemtic Name: methyl 5-[(6-cyclopropyl-1,3-dimethyl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]-2-fluoranyl-benzoate Openeye Name: methyl 5-[(6-cyclopropyl-1,3-dimethyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]-2-fluoro-benzoate CAS Name: 5-[[(6-cyclopropyl-1,3-dimethyl-4-pyrazolo[3,4-b]pyridinyl)-oxomethyl]amino]-2-fluorobenzoic acid methyl ester IUPAC Name: methyl 5-[(6-cyclopropyl-1,3-dimethylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]-2-fluorobenzoate Traditional Name: 5-[(6-cyclopropyl-1,3-dimethyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]-2-fluoro-benzoic acid methyl ester Formula: C20H19FN4O3 MolecularWeight: 382.388263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3CC3)C(=O)NC4=CC(=C(C=C4)F)C(=O)OC)C

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3CC3)C(=O)NC4=CC(=C(C=C4)F)C(=O)OC)C

InChI

InChI=1S/C20H19FN4O3/c1-10-17-14(9-16(11-4-5-11)23-18(17)25(2)24-10)19(26)22-12-6-7-15(21)13(8-12)20(27)28-3/h6-9,11H,4-5H2,1-3H3,(H,22,26)