Vitas-M small molecule compound
[3-(3-chloro-4-fluorophenyl)-4-methyl-2,6-dioxo-3,6-dihydropyrimidin-1(2H)-yl]acetic acid
Catalog ID
STL367209
SMILES OC(=O)Cn1c(=O)cc(n(c1=O)c1ccc(c(c1)Cl)F)C
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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 C13H10ClFN2O4 MW 312.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H10ClFN2O4/c1-7-4-11(18)16(6-12(19)20)13(21)17(7)8-2-3-10(15)9(14)5-8/h2-5H,6H2,1H3,(H,19,20)InChIKey
RIULSZGDNPTTLZ-UHFFFAOYSA-NSynonyms
(3(3chloro4fluorophenyl)4methyl26dioxo36dihydropyrimidin1(2H)yl)aceticacid
2(3(3chloro4fluorophenyl)4methyl26dioxopyrimidin1yl)aceticacid
CC1=CC(=O)N(C(=O)N1C2=CC(=C(C=C2)F)Cl)CC(=O)O
InChI=1SC13H10ClFN2O4c17411(18)16(612(19)20)13(21)17(7)82310(15)9(14)58h25H6H21H3(H1920)
MFCD27966499
ZINC000098063788
ZINC98063788
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