Vitas-M small molecule compound
5-(4-fluorobenzyl)-6-oxo-2-thioxo-1,2,3,6-tetrahydropyrimidin-4-olate
Catalog ID
STK236421
SMILES Fc1ccc(cc1)Cc1c([O-])[nH]c(=S)[nH]c1=O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C11H8FN2O2S MW 251.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H9FN2O2S/c12-7-3-1-6(2-4-7)5-8-9(15)13-11(17)14-10(8)16/h1-4H,5H2,(H3,13,14,15,16,17)/p-1InChIKey
HRUJIEPFJDYSDC-UHFFFAOYSA-MSynonyms
5((4fluorophenyl)methyl)4oxo2sulfanylidene1Hpyrimidin6olate
5(4fluorobenzyl)6oxo2thioxo1236tetrahydropyrimidin4olate
C1=CC(=CC=C1CC2=C(NC(=S)NC2=O)(O))F
Fc1ccc(cc1)Cc1c((O))(nH)c(=S)(nH)c1=O
InChI=1SC11H9FN2O2Sc127316(247)589(15)1311(17)1410(8)16h14H5H2(H31314151617)p1
MFCD08685384
ZINC000009190215
ZINC09190215
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