Vitas-M small molecule compound
ethyl 3-[2-(1H-benzimidazol-2-yl)-5-methyl-3-oxo-2,3-dihydro-1H-pyrazol-4-yl]propanoate
Catalog ID
STK627103
SMILES CCOC(=O)CCc1c(C)[nH]n(c1=O)c1nc2c([nH]1)cccc2
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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 C16H18N4O3 MW 314.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O3/c1-3-23-14(21)9-8-11-10(2)19-20(15(11)22)16-17-12-6-4-5-7-13(12)18-16/h4-7,19H,3,8-9H2,1-2H3,(H,17,18)InChIKey
CGGPOSVKMHPGGN-UHFFFAOYSA-NSynonyms
944782-88-1944782881
CCOC(=O)CCC1=C(NN(C1=O)C2=NC3=CC=CC=C3N2)C
CCOC(=O)CCc1c(C)(nH)n(c1=O)c1nc2c((nH)1)cccc2
ETHYL3(1BENZIMIDAZOL2YL5HYDROXY3METHYLPYRAZOL4YL)PROPANOATE
ethyl3(2(1Hbenzimidazol2yl)5methyl3oxo1Hpyrazol4yl)propanoate
ethyl3(2(1Hbenzimidazol2yl)5methyl3oxo23dihydro1Hpyrazol4yl)propanoate
InChI=1SC16H18N4O3c132314(21)981110(2)1920(15(11)22)161712645713(12)1816h4719H389H212H3(H1718)
MFCD09790779
ZINC000009060186
ZINC09060186
ZINC100137641
ZINC9060186
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