Vitas-M small molecule compound

ethyl {4-[3-amino-1-(3-hydroxy-4-methoxyphenyl)-3-oxopropyl]-5-oxo-2,5-dihydro-1H-pyrazol-3-yl}acetate

Catalog ID
STL435147
SMILES CCOC(=O)Cc1[nH][nH]c(=O)c1C(c1ccc(c(c1)O)OC)CC(=O)N

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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 C17H21N3O6 MW 363.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N3O6/c1-3-26-15(23)8-11-16(17(24)20-19-11)10(7-14(18)22)9-4-5-13(25-2)12(21)6-9/h4-6,10,21H,3,7-8H2,1-2H3,(H2,18,22)(H2,19,20,24)
InChIKey
OQCPDBCXZWKTIR-UHFFFAOYSA-N
Synonyms

CCOC(=O)Cc1(nH)(nH)c(=O)c1C(c1ccc(c(c1)O)OC)CC(=O)N
CCOC(=O)CC1=C(C(=O)NN1)C(CC(=O)N)C2=CC(=C(C=C2)OC)O
ethyl(4(3amino1(3hydroxy4methoxyphenyl)3oxopropyl)5oxo25dihydro1Hpyrazol3yl)acetate
ethyl2(4(3amino1(3hydroxy4methoxyphenyl)3oxopropyl)5oxo12dihydropyrazol3yl)acetate
InChI=1SC17H21N3O6c132615(23)81116(17(24)201911)10(714(18)22)94513(252)12(21)69h461021H378H212H3(H21822)(H2192024)
MFCD30711683
ZINC000253471286
ZINC000253471289

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Available files

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