4-azanyl-5-fluoranyl-1-[(2R,3S,4R)-3-fluoranyl-4-(hydroxymethyl)-3-methyl-thietan-2-yl]pyrimidin-2-one

Systemtic Name: 4-azanyl-5-fluoranyl-1-[(2R,3S,4R)-3-fluoranyl-4-(hydroxymethyl)-3-methyl-thietan-2-yl]pyrimidin-2-one Openeye Name: 4-amino-5-fluoro-1-[(2R,3S,4R)-3-fluoro-4-(hydroxymethyl)-3-methyl-thietan-2-yl]pyrimidin-2-one CAS Name: 4-amino-5-fluoro-1-[(2R,3S,4R)-3-fluoro-4-(hydroxymethyl)-3-methyl-2-thietanyl]-2-pyrimidinone IUPAC Name: 4-amino-5-fluoro-1-[(2R,3S,4R)-3-fluoro-4-(hydroxymethyl)-3-methylthietan-2-yl]pyrimidin-2-one Traditional Name: 4-amino-5-fluoro-1-[(2R,3S,4R)-3-fluoro-3-methyl-4-methylol-thietan-2-yl]pyrimidin-2-one Formula: C9H11F2N3O2S MolecularWeight: 263.264346

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(SC1N2C=C(C(=NC2=O)N)F)CO)F

Isomeric SMILES

C[C@@]1([C@H](S[C@H]1N2C=C(C(=NC2=O)N)F)CO)F

InChI

InChI=1S/C9H11F2N3O2S/c1-9(11)5(3-15)17-7(9)14-2-4(10)6(12)13-8(14)16/h2,5,7,15H,3H2,1H3,(H2,12,13,16)/t5-,7-,9+/m1/s1