[(2S,5R)-5-(4-benzamido-5-fluoranyl-2-oxidanylidene-pyrimidin-1-yl)-1,3-oxaselenolan-2-yl]methyl benzoate

Systemtic Name: [(2S,5R)-5-(4-benzamido-5-fluoranyl-2-oxidanylidene-pyrimidin-1-yl)-1,3-oxaselenolan-2-yl]methyl benzoate Openeye Name: [(2S,5R)-5-(4-benzamido-5-fluoro-2-oxo-pyrimidin-1-yl)-1,3-oxaselenolan-2-yl]methyl benzoate CAS Name: benzoic acid [(2S,5R)-5-(4-benzamido-5-fluoro-2-oxo-1-pyrimidinyl)-1,3-oxaselenolan-2-yl]methyl ester IUPAC Name: [(2S,5R)-5-(4-benzamido-5-fluoro-2-oxopyrimidin-1-yl)-1,3-oxaselenolan-2-yl]methyl benzoate Traditional Name: benzoic acid [(2S,5R)-5-(4-benzamido-5-fluoro-2-keto-pyrimidin-1-yl)-1,3-oxaselenolan-2-yl]methyl ester Formula: C22H18FN3O5Se MolecularWeight: 502.353823

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC([Se]1)COC(=O)C2=CC=CC=C2)N3C=C(C(=NC3=O)NC(=O)C4=CC=CC=C4)F

Isomeric SMILES

C1[C@@H](O[C@@H]([Se]1)COC(=O)C2=CC=CC=C2)N3C=C(C(=NC3=O)NC(=O)C4=CC=CC=C4)F

InChI

InChI=1S/C22H18FN3O5Se/c23-16-11-26(22(29)25-19(16)24-20(27)14-7-3-1-4-8-14)17-13-32-18(31-17)12-30-21(28)15-9-5-2-6-10-15/h1-11,17-18H,12-13H2,(H,24,25,27,29)/t17-,18+/m1/s1