(4,6-dimethyl-3-phenyl-1-pyridin-2-yl-pyrazolo[3,4-b]pyridin-5-yl) ethanoate

Systemtic Name: (4,6-dimethyl-3-phenyl-1-pyridin-2-yl-pyrazolo[3,4-b]pyridin-5-yl) ethanoate Openeye Name: [4,6-dimethyl-3-phenyl-1-(2-pyridyl)pyrazolo[3,4-b]pyridin-5-yl] acetate CAS Name: acetic acid [4,6-dimethyl-3-phenyl-1-(2-pyridinyl)-5-pyrazolo[3,4-b]pyridinyl] ester IUPAC Name: (4,6-dimethyl-3-phenyl-1-pyridin-2-ylpyrazolo[3,4-b]pyridin-5-yl) acetate Traditional Name: acetic acid [4,6-dimethyl-3-phenyl-1-(2-pyridyl)pyrazolo[3,4-b]pyridin-5-yl] ester Formula: C21H18N4O2 MolecularWeight: 358.39322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NN(C2=NC(=C1OC(=O)C)C)C3=CC=CC=N3)C4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=NN(C2=NC(=C1OC(=O)C)C)C3=CC=CC=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H18N4O2/c1-13-18-19(16-9-5-4-6-10-16)24-25(17-11-7-8-12-22-17)21(18)23-14(2)20(13)27-15(3)26/h4-12H,1-3H3