2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)ethanamide

Systemtic Name: 2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)ethanamide Openeye Name: N-(1-isopropylpyrazolo[3,4-b]pyridin-5-yl)-2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetamide CAS Name: 2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)-N-(1-propan-2-yl-5-pyrazolo[3,4-b]pyridinyl)acetamide IUPAC Name: 2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)acetamide Traditional Name: N-(1-isopropylpyrazolo[3,4-b]pyridin-5-yl)-2-(4-keto-2,3-dihydro-1,5-benzoxazepin-5-yl)acetamide Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=NC=C(C=C2C=N1)NC(=O)CN3C(=O)CCOC4=CC=CC=C43

Isomeric SMILES

CC(C)N1C2=NC=C(C=C2C=N1)NC(=O)CN3C(=O)CCOC4=CC=CC=C43

InChI

InChI=1S/C20H21N5O3/c1-13(2)25-20-14(10-22-25)9-15(11-21-20)23-18(26)12-24-16-5-3-4-6-17(16)28-8-7-19(24)27/h3-6,9-11,13H,7-8,12H2,1-2H3,(H,23,26)