7-chloranyl-4-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-1,4-benzoxazepin-5-one

Systemtic Name: 7-chloranyl-4-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-1,4-benzoxazepin-5-one Openeye Name: 7-chloro-4-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-1,4-benzoxazepin-5-one CAS Name: 7-chloro-4-[2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]-1,4-benzoxazepin-5-one IUPAC Name: 7-chloro-4-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-1,4-benzoxazepin-5-one Traditional Name: 7-chloro-4-[2-[4-(2-pyrimidyl)piperazino]ethyl]-1,4-benzoxazepin-5-one Formula: C19H20ClN5O2 MolecularWeight: 385.8474

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCN2C=COC3=C(C2=O)C=C(C=C3)Cl)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1CCN2C=COC3=C(C2=O)C=C(C=C3)Cl)C4=NC=CC=N4

InChI

InChI=1S/C19H20ClN5O2/c20-15-2-3-17-16(14-15)18(26)24(12-13-27-17)9-6-23-7-10-25(11-8-23)19-21-4-1-5-22-19/h1-5,12-14H,6-11H2