2-[1-ethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]-1,3-oxazole-4-carboxylic acid

Systemtic Name: 2-[1-ethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]-1,3-oxazole-4-carboxylic acid Openeye Name: 2-[1-ethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]oxazole-4-carboxylic acid CAS Name: 2-[1-ethyl-4-(4-oxanylamino)-5-pyrazolo[3,4-b]pyridinyl]-4-oxazolecarboxylic acid IUPAC Name: 2-[1-ethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]-1,3-oxazole-4-carboxylic acid Traditional Name: 2-[1-ethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]oxazole-4-carboxylic acid Formula: C17H19N5O4 MolecularWeight: 357.36386

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC=C(C(=C2C=N1)NC3CCOCC3)C4=NC(=CO4)C(=O)O

Isomeric SMILES

CCN1C2=NC=C(C(=C2C=N1)NC3CCOCC3)C4=NC(=CO4)C(=O)O

InChI

InChI=1S/C17H19N5O4/c1-2-22-15-11(8-19-22)14(20-10-3-5-25-6-4-10)12(7-18-15)16-21-13(9-26-16)17(23)24/h7-10H,2-6H2,1H3,(H,18,20)(H,23,24)