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

Systemtic Name: methyl 3-[(1-ethyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 3-[[1-ethyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carbonyl]amino]-3-phenyl-propanoate CAS Name: 3-[[(1-ethyl-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinyl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-[(1-ethyl-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]-3-phenylpropanoate Traditional Name: 3-[[1-ethyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carbonyl]amino]-3-phenyl-propionic acid methyl ester Formula: C23H22N4O3S MolecularWeight: 434.51078

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)NC(CC(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)NC(CC(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C23H22N4O3S/c1-3-27-22-17(14-24-27)16(12-19(25-22)20-10-7-11-31-20)23(29)26-18(13-21(28)30-2)15-8-5-4-6-9-15/h4-12,14,18H,3,13H2,1-2H3,(H,26,29)