Vitas-M small molecule compound
4-{1-acetyl-3-[2-(acetyloxy)-5-chlorophenyl]-4,5-dihydro-1H-pyrazol-5-yl}-2-methoxyphenyl acetate
Catalog ID
STK731188
SMILES COc1cc(ccc1OC(=O)C)C1CC(=NN1C(=O)C)c1cc(Cl)ccc1OC(=O)C
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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 C22H21ClN2O6 MW 444.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN2O6/c1-12(26)25-19(15-5-7-21(31-14(3)28)22(9-15)29-4)11-18(24-25)17-10-16(23)6-8-20(17)30-13(2)27/h5-10,19H,11H2,1-4H3InChIKey
DBZYQZNFXUYSMG-UHFFFAOYSA-NSynonyms
730252-58-1(2(2ACETYL3(4ACETYLOXY3METHOXYPHENYL)34DIHYDROPYRAZOL5YL)4CHLOROPHENYL)ACETATE
2(5(4acetoxy3methoxyphenyl)1acetyl45dihydro1Hpyrazol3yl)4chlorophenylacetate
4(1acetyl3(2(acetyloxy)5chlorophenyl)45dihydro1Hpyrazol5yl)2methoxyphenylacetate
730252581
CC(=O)N1C(CC(=N1)C2=C(C=CC(=C2)Cl)OC(=O)C)C3=CC(=C(C=C3)OC(=O)C)OC
InChI=1SC22H21ClN2O6c112(26)2519(155721(3114(3)28)22(915)294)1118(2425)171016(23)6820(17)3013(2)27h51019H11H214H3
MFCD03972388
ZINC000008914178
ZINC000009403381
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