3-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl]-2-methyl-propanoic acid

Systemtic Name: 3-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl]-2-methyl-propanoic acid Openeye Name: 3-[2-[(4-fluorophenyl)methylsulfanyl]-4-hydroxy-6-oxo-1H-pyrimidin-5-yl]-2-methyl-propanoic acid CAS Name: 3-[2-[(4-fluorophenyl)methylthio]-4-hydroxy-6-oxo-1H-pyrimidin-5-yl]-2-methylpropanoic acid IUPAC Name: 3-[2-[(4-fluorophenyl)methylsulfanyl]-4-hydroxy-6-oxo-1H-pyrimidin-5-yl]-2-methylpropanoic acid Traditional Name: 3-[2-[(4-fluorobenzyl)thio]-4-hydroxy-6-keto-1H-pyrimidin-5-yl]-2-methyl-propionic acid Formula: C15H15FN2O4S MolecularWeight: 338.354003

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C(N=C(NC1=O)SCC2=CC=C(C=C2)F)O)C(=O)O

Isomeric SMILES

CC(CC1=C(N=C(NC1=O)SCC2=CC=C(C=C2)F)O)C(=O)O

InChI

InChI=1S/C15H15FN2O4S/c1-8(14(21)22)6-11-12(19)17-15(18-13(11)20)23-7-9-2-4-10(16)5-3-9/h2-5,8H,6-7H2,1H3,(H,21,22)(H2,17,18,19,20)