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

Systemtic Name: methyl 3-[[6-(furan-2-yl)-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl]carbonylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[[6-(2-furyl)-1-isopropyl-pyrazolo[3,4-b]pyridine-4-carbonyl]amino]-3-(2-thienyl)propanoate CAS Name: 3-[[[6-(2-furanyl)-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinyl]-oxomethyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[[6-(furan-2-yl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carbonyl]amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[[6-(2-furyl)-1-isopropyl-pyrazolo[3,4-b]pyridine-4-carbonyl]amino]-3-(2-thienyl)propionic acid methyl ester Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3=CC=CO3)C(=O)NC(CC(=O)OC)C4=CC=CS4

Isomeric SMILES

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3=CC=CO3)C(=O)NC(CC(=O)OC)C4=CC=CS4

InChI

InChI=1S/C22H22N4O4S/c1-13(2)26-21-15(12-23-26)14(10-16(24-21)18-6-4-8-30-18)22(28)25-17(11-20(27)29-3)19-7-5-9-31-19/h4-10,12-13,17H,11H2,1-3H3,(H,25,28)