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4-azanyl-1-(diethylaminomethyl)-5-fluoranyl-pyrimidin-2-one hydrate

4-azanyl-1-(diethylaminomethyl)-5-fluoranyl-pyrimidin-2-one hydrate

Systemtic Name:4-azanyl-1-(diethylaminomethyl)-5-fluoranyl-pyrimidin-2-one hydrate
Openeye Name:4-amino-1-(diethylaminomethyl)-5-fluoro-pyrimidin-2-one hydrate
CAS Name:4-amino-1-(diethylaminomethyl)-5-fluoro-2-pyrimidinone hydrate
IUPAC Name:4-amino-1-(diethylaminomethyl)-5-fluoropyrimidin-2-one hydrate
Traditional Name:4-amino-1-(diethylaminomethyl)-5-fluoro-pyrimidin-2-one hydrate
Formula: C9H17FN4O2
MolecularWeight: 232.255283
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CN1C=C(C(=NC1=O)N)F.O


Isomeric SMILES

CCN(CC)CN1C=C(C(=NC1=O)N)F.O


InChI

InChI=1S/C9H15FN4O.H2O/c1-3-13(4-2)6-14-5-7(10)8(11)12-9(14)15;/h5H,3-4,6H2,1-2H3,(H2,11,12,15);1H2


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