1-[5-(2,4-dimethoxypyrimidin-5-yl)-1,3-oxazol-2-yl]-7-phenyl-heptan-1-one

Systemtic Name: 1-[5-(2,4-dimethoxypyrimidin-5-yl)-1,3-oxazol-2-yl]-7-phenyl-heptan-1-one Openeye Name: 1-[5-(2,4-dimethoxypyrimidin-5-yl)oxazol-2-yl]-7-phenyl-heptan-1-one CAS Name: 1-[5-(2,4-dimethoxy-5-pyrimidinyl)-2-oxazolyl]-7-phenyl-1-heptanone IUPAC Name: 1-[5-(2,4-dimethoxypyrimidin-5-yl)-1,3-oxazol-2-yl]-7-phenylheptan-1-one Traditional Name: 1-[5-(2,4-dimethoxypyrimidin-5-yl)oxazol-2-yl]-7-phenyl-heptan-1-one Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1C2=CN=C(O2)C(=O)CCCCCCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=NC(=NC=C1C2=CN=C(O2)C(=O)CCCCCCC3=CC=CC=C3)OC

InChI

InChI=1S/C22H25N3O4/c1-27-20-17(14-24-22(25-20)28-2)19-15-23-21(29-19)18(26)13-9-4-3-6-10-16-11-7-5-8-12-16/h5,7-8,11-12,14-15H,3-4,6,9-10,13H2,1-2H3