2-[(3-chloranyl-6H-benzo[b][1,4]benzoxazepin-5-yl)methyl]-N-pyrimidin-5-yl-1,3-oxazole-4-carboxamide

Systemtic Name: 2-[(3-chloranyl-6H-benzo[b][1,4]benzoxazepin-5-yl)methyl]-N-pyrimidin-5-yl-1,3-oxazole-4-carboxamide Openeye Name: 2-[(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)methyl]-N-pyrimidin-5-yl-oxazole-4-carboxamide CAS Name: 2-[(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)methyl]-N-(5-pyrimidinyl)-4-oxazolecarboxamide IUPAC Name: 2-[(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)methyl]-N-pyrimidin-5-yl-1,3-oxazole-4-carboxamide Traditional Name: 2-[(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)methyl]-N-(5-pyrimidyl)oxazole-4-carboxamide Formula: C22H16ClN5O3 MolecularWeight: 433.84714

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2OC3=C(N1CC4=NC(=CO4)C(=O)NC5=CN=CN=C5)C=C(C=C3)Cl

Isomeric SMILES

C1C2=CC=CC=C2OC3=C(N1CC4=NC(=CO4)C(=O)NC5=CN=CN=C5)C=C(C=C3)Cl

InChI

InChI=1S/C22H16ClN5O3/c23-15-5-6-20-18(7-15)28(10-14-3-1-2-4-19(14)31-20)11-21-27-17(12-30-21)22(29)26-16-8-24-13-25-9-16/h1-9,12-13H,10-11H2,(H,26,29)