6-chloranyl-4-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-1,4-benzoxazin-3-one

Systemtic Name: 6-chloranyl-4-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-1,4-benzoxazin-3-one Openeye Name: 6-chloro-4-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-1,4-benzoxazin-3-one CAS Name: 6-chloro-4-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]-1,4-benzoxazin-3-one IUPAC Name: 6-chloro-4-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-1,4-benzoxazin-3-one Traditional Name: 6-chloro-4-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl]-1,4-benzoxazin-3-one Formula: C18H18ClN5O3 MolecularWeight: 387.82022

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CN3C(=O)COC4=C3C=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CN3C(=O)COC4=C3C=C(C=C4)Cl

InChI

InChI=1S/C18H18ClN5O3/c19-13-2-3-15-14(10-13)24(17(26)12-27-15)11-16(25)22-6-8-23(9-7-22)18-20-4-1-5-21-18/h1-5,10H,6-9,11-12H2