ethyl 2-[(3,6-dimethyl-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(3,6-dimethyl-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(1-isopropyl-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[(3,6-dimethyl-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinyl)-oxomethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3,6-dimethyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(1-isopropyl-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=CC(=NC3=C2C(=NN3C(C)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=CC(=NC3=C2C(=NN3C(C)C)C)C

InChI

InChI=1S/C21H26N4O3S/c1-8-28-21(27)16-12(5)14(7)29-20(16)23-19(26)15-9-11(4)22-18-17(15)13(6)24-25(18)10(2)3/h9-10H,8H2,1-7H3,(H,23,26)