[2-[[5-fluoranyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl-methylsulfonyl-amino]-3-oxidanyl-propyl] benzoate

Systemtic Name: [2-[[5-fluoranyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl-methylsulfonyl-amino]-3-oxidanyl-propyl] benzoate Openeye Name: [2-[(5-fluoro-2,4-dioxo-pyrimidin-1-yl)methyl-methylsulfonyl-amino]-3-hydroxy-propyl] benzoate CAS Name: benzoic acid [2-[(5-fluoro-2,4-dioxo-1-pyrimidinyl)methyl-methylsulfonylamino]-3-hydroxypropyl] ester IUPAC Name: [2-[(5-fluoro-2,4-dioxopyrimidin-1-yl)methyl-methylsulfonylamino]-3-hydroxypropyl] benzoate Traditional Name: benzoic acid [2-[(5-fluoro-2,4-diketo-pyrimidin-1-yl)methyl-mesyl-amino]-3-hydroxy-propyl] ester Formula: C16H18FN3O7S MolecularWeight: 415.393423

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CN1C=C(C(=O)NC1=O)F)C(CO)COC(=O)C2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)N(CN1C=C(C(=O)NC1=O)F)C(CO)COC(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H18FN3O7S/c1-28(25,26)20(10-19-7-13(17)14(22)18-16(19)24)12(8-21)9-27-15(23)11-5-3-2-4-6-11/h2-7,12,21H,8-10H2,1H3,(H,18,22,24)