Vitas-M small molecule compound
methyl 3-[5-(2,3-dihydro-1-benzofuran-5-ylmethyl)-3-hydroxy-1H-pyrazol-4-yl]-3-(furan-2-yl)propanoate
Catalog ID
STL411301
SMILES COC(=O)CC(c1c([nH]nc1O)Cc1ccc2c(c1)CCO2)c1ccco1
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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 C20H20N2O5 MW 368.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O5/c1-25-18(23)11-14(17-3-2-7-26-17)19-15(21-22-20(19)24)10-12-4-5-16-13(9-12)6-8-27-16/h2-5,7,9,14H,6,8,10-11H2,1H3,(H2,21,22,24)InChIKey
OPXDBEOQZRHNOX-UHFFFAOYSA-NSynonyms
1574294-11-31574294113
COC(=O)CC(C1=CC=CO1)C2=C(NNC2=O)CC3=CC4=C(C=C3)OCC4
COC(=O)CC(c1c((nH)nc1O)Cc1ccc2c(c1)CCO2)c1ccco1
InChI=1SC20H20N2O5c12518(23)1114(173272617)1915(212220(19)24)1012451613(912)682716h257914H681011H21H3(H2212224)
methyl3(3(23dihydro1benzofuran5ylmethyl)5oxo12dihydropyrazol4yl)3(furan2yl)propanoate
methyl3(5(23dihydro1benzofuran5ylmethyl)3hydroxy1Hpyrazol4yl)3(furan2yl)propanoate
MFCD30706643
ZINC000096230996
ZINC000096230997
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