ethyl 4-(2-methylpropyl)-2-[(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(2-methylpropyl)-2-[(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-isobutyl-2-[(1-isopropylpyrazolo[3,4-b]pyridine-5-carbonyl)amino]thiophene-3-carboxylate CAS Name: 4-(2-methylpropyl)-2-[[oxo-(1-propan-2-yl-5-pyrazolo[3,4-b]pyridinyl)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-methylpropyl)-2-[(1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 4-isobutyl-2-[(1-isopropylpyrazolo[3,4-b]pyridine-5-carbonyl)amino]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=C1CC(C)C)NC(=O)C2=CN=C3C(=C2)C=NN3C(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1CC(C)C)NC(=O)C2=CN=C3C(=C2)C=NN3C(C)C

InChI

InChI=1S/C21H26N4O3S/c1-6-28-21(27)17-16(7-12(2)3)11-29-20(17)24-19(26)15-8-14-10-23-25(13(4)5)18(14)22-9-15/h8-13H,6-7H2,1-5H3,(H,24,26)