methyl 4-[[(6-methyl-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[(6-methyl-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[(1-isopropyl-6-methyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]methyl]benzoate CAS Name: 4-[[[(6-methyl-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinyl)-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]methyl]benzoate Traditional Name: 4-[[(1-isopropyl-6-methyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]methyl]benzoic acid methyl ester Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2C(C)C)C(=C1)C(=O)NCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=NC2=C(C=NN2C(C)C)C(=C1)C(=O)NCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H22N4O3/c1-12(2)24-18-17(11-22-24)16(9-13(3)23-18)19(25)21-10-14-5-7-15(8-6-14)20(26)27-4/h5-9,11-12H,10H2,1-4H3,(H,21,25)