4-(4-fluorophenyl)-3-(2-phenoxypyrimidin-4-yl)-2-(2-piperazin-1-ylethyl)-1,2-oxazol-5-one

Systemtic Name: 4-(4-fluorophenyl)-3-(2-phenoxypyrimidin-4-yl)-2-(2-piperazin-1-ylethyl)-1,2-oxazol-5-one Openeye Name: 4-(4-fluorophenyl)-3-(2-phenoxypyrimidin-4-yl)-2-(2-piperazin-1-ylethyl)isoxazol-5-one CAS Name: 4-(4-fluorophenyl)-3-(2-phenoxy-4-pyrimidinyl)-2-[2-(1-piperazinyl)ethyl]-5-isoxazolone IUPAC Name: 4-(4-fluorophenyl)-3-(2-phenoxypyrimidin-4-yl)-2-(2-piperazin-1-ylethyl)-1,2-oxazol-5-one Traditional Name: 4-(4-fluorophenyl)-3-(2-phenoxypyrimidin-4-yl)-2-(2-piperazinoethyl)-3-isoxazolin-5-one Formula: C25H24FN5O3 MolecularWeight: 461.488163

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CCN2C(=C(C(=O)O2)C3=CC=C(C=C3)F)C4=NC(=NC=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1)CCN2C(=C(C(=O)O2)C3=CC=C(C=C3)F)C4=NC(=NC=C4)OC5=CC=CC=C5

InChI

InChI=1S/C25H24FN5O3/c26-19-8-6-18(7-9-19)22-23(31(34-24(22)32)17-16-30-14-12-27-13-15-30)21-10-11-28-25(29-21)33-20-4-2-1-3-5-20/h1-11,27H,12-17H2