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

Systemtic Name: methyl 4-methyl-3-[(1-propan-2-yl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]benzoate Openeye Name: methyl 3-[[1-isopropyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carbonyl]amino]-4-methyl-benzoate CAS Name: 4-methyl-3-[[oxo-(1-propan-2-yl-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinyl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[(1-propan-2-yl-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]benzoate Traditional Name: 3-[[1-isopropyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carbonyl]amino]-4-methyl-benzoic acid methyl ester Formula: C23H22N4O3S MolecularWeight: 434.51078

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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=NN3C(C)C)C4=CC=CS4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC(=NC3=C2C=NN3C(C)C)C4=CC=CS4

InChI

InChI=1S/C23H22N4O3S/c1-13(2)27-21-17(12-24-27)16(11-19(25-21)20-6-5-9-31-20)22(28)26-18-10-15(23(29)30-4)8-7-14(18)3/h5-13H,1-4H3,(H,26,28)