Vitas-M small molecule compound
3-[4-(butan-2-yl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]propanoic acid
Catalog ID
STL145284
SMILES CCC(n1c2nnc(n2c2c(c1=O)scc2)CCC(=O)O)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 C14H16N4O3S MW 320.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N4O3S/c1-3-8(2)17-13(21)12-9(6-7-22-12)18-10(4-5-11(19)20)15-16-14(17)18/h6-8H,3-5H2,1-2H3,(H,19,20)InChIKey
NHBAGNOICGUIQR-UHFFFAOYSA-NSynonyms
3(4(butan2yl)5oxo45dihydrothieno(23e)(124)triazolo(43a)pyrimidin1yl)propanoicacid
CCC(C)N1C(=O)C2=C(C=CS2)N3C1=NN=C3CCC(=O)O
InChI=1SC14H16N4O3Sc138(2)1713(21)129(672212)1810(4511(19)20)151614(17)18h68H35H212H3(H1920)
MFCD20754881
ZINC000071328577
ZINC000071328578
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