2-[5-[[2-[(4-fluorophenyl)methylsulfanyl]-1-methyl-4-oxidanylidene-pyrimidin-5-yl]methyl]-2-oxidanylidene-pyrimidin-1-yl]ethanoic acid

Systemtic Name: 2-[5-[[2-[(4-fluorophenyl)methylsulfanyl]-1-methyl-4-oxidanylidene-pyrimidin-5-yl]methyl]-2-oxidanylidene-pyrimidin-1-yl]ethanoic acid Openeye Name: 2-[5-[[2-[(4-fluorophenyl)methylsulfanyl]-1-methyl-4-oxo-pyrimidin-5-yl]methyl]-2-oxo-pyrimidin-1-yl]acetic acid CAS Name: 2-[5-[[2-[(4-fluorophenyl)methylthio]-1-methyl-4-oxo-5-pyrimidinyl]methyl]-2-oxo-1-pyrimidinyl]acetic acid IUPAC Name: 2-[5-[[2-[(4-fluorophenyl)methylsulfanyl]-1-methyl-4-oxopyrimidin-5-yl]methyl]-2-oxopyrimidin-1-yl]acetic acid Traditional Name: 2-[5-[[2-[(4-fluorobenzyl)thio]-4-keto-1-methyl-pyrimidin-5-yl]methyl]-2-keto-pyrimidin-1-yl]acetic acid Formula: C19H17FN4O4S MolecularWeight: 416.426083

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)N=C1SCC2=CC=C(C=C2)F)CC3=CN(C(=O)N=C3)CC(=O)O

Isomeric SMILES

CN1C=C(C(=O)N=C1SCC2=CC=C(C=C2)F)CC3=CN(C(=O)N=C3)CC(=O)O

InChI

InChI=1S/C19H17FN4O4S/c1-23-9-14(6-13-7-21-18(28)24(8-13)10-16(25)26)17(27)22-19(23)29-11-12-2-4-15(20)5-3-12/h2-5,7-9H,6,10-11H2,1H3,(H,25,26)