[4-(4-azanyl-5-fluoranyl-2-oxidanylidene-pyrimidin-1-yl)thiolan-2-yl]methyl butanoate

Systemtic Name: [4-(4-azanyl-5-fluoranyl-2-oxidanylidene-pyrimidin-1-yl)thiolan-2-yl]methyl butanoate Openeye Name: [4-(4-amino-5-fluoro-2-oxo-pyrimidin-1-yl)tetrahydrothiophen-2-yl]methyl butanoate CAS Name: butanoic acid [4-(4-amino-5-fluoro-2-oxo-1-pyrimidinyl)-2-thiolanyl]methyl ester IUPAC Name: [4-(4-amino-5-fluoro-2-oxopyrimidin-1-yl)thiolan-2-yl]methyl butanoate Traditional Name: butyric acid [4-(4-amino-5-fluoro-2-keto-pyrimidin-1-yl)tetrahydrothiophen-2-yl]methyl ester Formula: C13H18FN3O3S MolecularWeight: 315.363723

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC1CC(CS1)N2C=C(C(=NC2=O)N)F

Isomeric SMILES

CCCC(=O)OCC1CC(CS1)N2C=C(C(=NC2=O)N)F

InChI

InChI=1S/C13H18FN3O3S/c1-2-3-11(18)20-6-9-4-8(7-21-9)17-5-10(14)12(15)16-13(17)19/h5,8-9H,2-4,6-7H2,1H3,(H2,15,16,19)