4-azanyl-1-[(E)-4-fluoranyl-3-(hydroxymethyl)but-3-enyl]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[(E)-4-fluoranyl-3-(hydroxymethyl)but-3-enyl]pyrimidin-2-one Openeye Name: 4-amino-1-[(E)-4-fluoro-3-(hydroxymethyl)but-3-enyl]pyrimidin-2-one CAS Name: 4-amino-1-[(E)-4-fluoro-3-(hydroxymethyl)but-3-enyl]-2-pyrimidinone IUPAC Name: 4-amino-1-[(E)-4-fluoro-3-(hydroxymethyl)but-3-enyl]pyrimidin-2-one Traditional Name: 4-amino-1-[(E)-4-fluoro-3-methylol-but-3-enyl]pyrimidin-2-one Formula: C9H12FN3O2 MolecularWeight: 213.208883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=O)N=C1N)CCC(=CF)CO

Isomeric SMILES

C1=CN(C(=O)N=C1N)CC/C(=C\F)/CO

InChI

InChI=1S/C9H12FN3O2/c10-5-7(6-14)1-3-13-4-2-8(11)12-9(13)15/h2,4-5,14H,1,3,6H2,(H2,11,12,15)/b7-5+