N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]-1-propan-2-yl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]-1-propan-2-yl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: 1-isopropyl-N-methyl-N-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-methyl-N-[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]-1-propan-2-yl-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-1-propan-2-yl-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: 1-isopropyl-N-[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl]-N-methyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C21H22N6O3S MolecularWeight: 438.50278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CN(C)C(=O)C2=CC(=NC3=C2C=NN3C(C)C)C4=CC=CS4

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CN(C)C(=O)C2=CC(=NC3=C2C=NN3C(C)C)C4=CC=CS4

InChI

InChI=1S/C21H22N6O3S/c1-12(2)27-20-15(10-22-27)14(9-16(23-20)17-6-5-7-31-17)21(29)26(4)11-19(28)24-18-8-13(3)30-25-18/h5-10,12H,11H2,1-4H3,(H,24,25,28)