Vitas-M small molecule compound
4-{[(7-hydroxy-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrimidin-5-yl)carbonyl]amino}benzoic acid
Catalog ID
STL154962
SMILES O=C(C1CC(=Nc2n1cnn2)O)Nc1ccc(cc1)C(=O)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 C13H11N5O4 MW 301.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11N5O4/c19-10-5-9(18-6-14-17-13(18)16-10)11(20)15-8-3-1-7(2-4-8)12(21)22/h1-4,6,9H,5H2,(H,15,20)(H,21,22)(H,16,17,19)InChIKey
CKYDXGSZEIVVMD-UHFFFAOYSA-NSynonyms
1246040-87-81246040878
4(((7hydroxy56dihydro(124)triazolo(43a)pyrimidin5yl)carbonyl)amino)benzoicacid
4((7oxo56dihydro1H(124)triazolo(43a)pyrimidine5carbonyl)amino)benzoicacid
C1C(N2C=NNC2=NC1=O)C(=O)NC3=CC=C(C=C3)C(=O)O
InChI=1SC13H11N5O4c191059(186141713(18)1610)11(20)158317(248)12(21)22h1469H5H2(H1520)(H2122)(H161719)
MFCD20757151
ZINC000049551826
ZINC000049551828
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