methyl 7-[[6-(furan-2-yl)-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl]carbonylamino]heptanoate

Systemtic Name: methyl 7-[[6-(furan-2-yl)-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl]carbonylamino]heptanoate Openeye Name: methyl 7-[[6-(2-furyl)-1-isopropyl-pyrazolo[3,4-b]pyridine-4-carbonyl]amino]heptanoate CAS Name: 7-[[[6-(2-furanyl)-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinyl]-oxomethyl]amino]heptanoic acid methyl ester IUPAC Name: methyl 7-[[6-(furan-2-yl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carbonyl]amino]heptanoate Traditional Name: 7-[[6-(2-furyl)-1-isopropyl-pyrazolo[3,4-b]pyridine-4-carbonyl]amino]enanthic acid methyl ester Formula: C22H28N4O4 MolecularWeight: 412.48212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3=CC=CO3)C(=O)NCCCCCCC(=O)OC

Isomeric SMILES

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3=CC=CO3)C(=O)NCCCCCCC(=O)OC

InChI

InChI=1S/C22H28N4O4/c1-15(2)26-21-17(14-24-26)16(13-18(25-21)19-9-8-12-30-19)22(28)23-11-7-5-4-6-10-20(27)29-3/h8-9,12-15H,4-7,10-11H2,1-3H3,(H,23,28)