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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CCN3C4=C(C=C(C=C4)Cl)OC3=O

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CCN3C4=C(C=C(C=C4)Cl)OC3=O

InChI

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