[3-acetyloxy-5-[4-azanyl-2-oxidanylidene-5-[(phenylmethyl)amino]pyrimidin-1-yl]-4-fluoranyl-oxolan-2-yl]methyl benzoate

Systemtic Name: [3-acetyloxy-5-[4-azanyl-2-oxidanylidene-5-[(phenylmethyl)amino]pyrimidin-1-yl]-4-fluoranyl-oxolan-2-yl]methyl benzoate Openeye Name: [3-acetoxy-5-[4-amino-5-(benzylamino)-2-oxo-pyrimidin-1-yl]-4-fluoro-tetrahydrofuran-2-yl]methyl benzoate CAS Name: benzoic acid [3-acetyloxy-5-[4-amino-2-oxo-5-[(phenylmethyl)amino]-1-pyrimidinyl]-4-fluoro-2-oxolanyl]methyl ester IUPAC Name: [3-acetyloxy-5-[4-amino-5-(benzylamino)-2-oxopyrimidin-1-yl]-4-fluorooxolan-2-yl]methyl benzoate Traditional Name: benzoic acid [3-acetoxy-5-[4-amino-5-(benzylamino)-2-keto-pyrimidin-1-yl]-4-fluoro-tetrahydrofuran-2-yl]methyl ester Formula: C25H25FN4O6 MolecularWeight: 496.487603

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(OC(C1F)N2C=C(C(=NC2=O)N)NCC3=CC=CC=C3)COC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)OC1C(OC(C1F)N2C=C(C(=NC2=O)N)NCC3=CC=CC=C3)COC(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H25FN4O6/c1-15(31)35-21-19(14-34-24(32)17-10-6-3-7-11-17)36-23(20(21)26)30-13-18(22(27)29-25(30)33)28-12-16-8-4-2-5-9-16/h2-11,13,19-21,23,28H,12,14H2,1H3,(H2,27,29,33)