Vitas-M small molecule compound
1-{4-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-2-hydroxypropoxy]-3-methoxyphenyl}ethanone
Catalog ID
STK782174
SMILES COc1cc(ccc1OCC(Cn1nc(c(c1C)Cl)C)O)C(=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 C17H21ClN2O4 MW 352.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21ClN2O4/c1-10-17(18)11(2)20(19-10)8-14(22)9-24-15-6-5-13(12(3)21)7-16(15)23-4/h5-7,14,22H,8-9H2,1-4H3InChIKey
KGIJLGSBXJSJRO-UHFFFAOYSA-NSynonyms
1(4(3(4chloro35dimethyl1Hpyrazol1yl)2hydroxypropoxy)3methoxyphenyl)ethanone
1(4(3(4CHLORO35DIMETHYLPYRAZOL1YL)2HYDROXYPROPOXY)3METHOXYPHENYL)ETHANONE
CC1=C(C(=NN1CC(COC2=C(C=C(C=C2)C(=O)C)OC)O)C)Cl
InChI=1SC17H21ClN2O4c11017(18)11(2)20(1910)814(22)924156513(12(3)21)716(15)234h571422H89H214H3
MFCD06016947
ZINC000004727738
ZINC000004727739
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