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

Systemtic Name: methyl 4-methyl-3-[[6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[3,4-b]pyridin-4-yl]carbonylamino]benzoate Openeye Name: methyl 4-methyl-3-[[6-phenyl-1-(4-pyridylmethyl)pyrazolo[3,4-b]pyridine-4-carbonyl]amino]benzoate CAS Name: 4-methyl-3-[[oxo-[6-phenyl-1-(pyridin-4-ylmethyl)-4-pyrazolo[3,4-b]pyridinyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[3,4-b]pyridine-4-carbonyl]amino]benzoate Traditional Name: 4-methyl-3-[[6-phenyl-1-(4-pyridylmethyl)pyrazolo[3,4-b]pyridine-4-carbonyl]amino]benzoic acid methyl ester Formula: C28H23N5O3 MolecularWeight: 477.51392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC(=NC3=C2C=NN3CC4=CC=NC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC(=NC3=C2C=NN3CC4=CC=NC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H23N5O3/c1-18-8-9-21(28(35)36-2)14-24(18)32-27(34)22-15-25(20-6-4-3-5-7-20)31-26-23(22)16-30-33(26)17-19-10-12-29-13-11-19/h3-16H,17H2,1-2H3,(H,32,34)