Vitas-M small molecule compound
methyl 3-(3-hydroxy-5-methyl-1H-pyrazol-4-yl)-3-(2-hydroxyquinolin-3-yl)propanoate
Catalog ID
STL315575
SMILES COC(=O)CC(c1c(C)[nH]nc1O)c1cc2ccccc2nc1O
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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 C17H17N3O4 MW 327.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O4/c1-9-15(17(23)20-19-9)11(8-14(21)24-2)12-7-10-5-3-4-6-13(10)18-16(12)22/h3-7,11H,8H2,1-2H3,(H,18,22)(H2,19,20,23)InChIKey
SWRIHHKYRLZCOZ-UHFFFAOYSA-NSynonyms
1435984-44-31435984443
CC1=C(C(=O)NN1)C(CC(=O)OC)C2=CC3=CC=CC=C3NC2=O
COC(=O)CC(c1c(C)(nH)nc1O)c1cc2ccccc2nc1O
InChI=1SC17H17N3O4c1915(17(23)20199)11(814(21)242)12710534613(10)1816(12)22h3711H8H212H3(H1822)(H2192023)
methyl3(3hydroxy5methyl1Hpyrazol4yl)3(2hydroxyquinolin3yl)propanoate
methyl3(3methyl5oxo12dihydropyrazol4yl)3(2oxo1Hquinolin3yl)propanoate
MFCD28027334
ZINC000095477155
ZINC000095477156
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