Vitas-M small molecule compound
2-[1-acetyl-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-4-chlorophenyl acetate
Catalog ID
STK864652
SMILES COc1cc(ccc1OC)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 C21H21ClN2O5 MW 416.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN2O5/c1-12(25)24-18(14-5-7-20(27-3)21(9-14)28-4)11-17(23-24)16-10-15(22)6-8-19(16)29-13(2)26/h5-10,18H,11H2,1-4H3InChIKey
OEROQAWCBVCJLV-UHFFFAOYSA-NSynonyms
693230-62-5(2(2ACETYL3(34DIMETHOXYPHENYL)34DIHYDROPYRAZOL5YL)4CHLOROPHENYL)ACETATE
2((5R)1ACETYL5(34DIMETHOXYPHENYL)45DIHYDRO1HPYRAZOL3YL)4CHLOROPHENYLACETATE
2((5S)1ACETYL5(34DIMETHOXYPHENYL)45DIHYDRO1HPYRAZOL3YL)4CHLOROPHENYLACETATE
2(1acetyl5(34dimethoxyphenyl)45dihydro1Hpyrazol3yl)4chlorophenylacetate
693230625
CC(=O)N1C(CC(=N1)C2=C(C=CC(=C2)Cl)OC(=O)C)C3=CC(=C(C=C3)OC)OC
InChI=1SC21H21ClN2O5c112(25)2418(145720(273)21(914)284)1117(2324)161015(22)6819(16)2913(2)26h51018H11H214H3
MFCD03686152
ZINC000001142395
ZINC000001142396
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