Vitas-M small molecule compound

4,4'-({4-[(2-chlorobenzyl)oxy]-3-ethoxyphenyl}methanediyl)bis(3-methyl-1H-pyrazol-5-ol)

Catalog ID
STK052451
SMILES CCOc1cc(ccc1OCc1ccccc1Cl)C(c1c(C)n[nH]c1O)c1c(C)n[nH]c1O

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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 C24H25ClN4O4 MW 468.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25ClN4O4/c1-4-32-19-11-15(9-10-18(19)33-12-16-7-5-6-8-17(16)25)22(20-13(2)26-28-23(20)30)21-14(3)27-29-24(21)31/h5-11,22H,4,12H2,1-3H3,(H2,26,28,30)(H2,27,29,31)
InChIKey
AUIIHPBDTVNGBJ-UHFFFAOYSA-N
Synonyms
879457-60-0
4((4((2CHLOROPHENYL)METHOXY)3ETHOXYPHENYL)(3METHYL5OXO12DIHYDROPYRAZOL4YL)METHYL)5METHYL12DIHYDROPYRAZOL3ONE
44((4((2CHLOROBENZYL)OXY)3ETHOXYPHENYL)METHANEDIYL)BIS(3METHYL1HPYRAZOL5OL)
44((4((2CHLOROBENZYL)OXY)3ETHOXYPHENYL)METHANEDIYL)BIS(5METHYL12DIHYDRO3HPYRAZOL3ONE)
44((4((2chlorobenzyl)oxy)3ethoxyphenyl)methylene)bis(3methyl1Hpyrazol5ol)
879457600
CCOC1=C(C=CC(=C1)C(C2=C(NNC2=O)C)C3=C(NNC3=O)C)OCC4=CC=CC=C4Cl
CCOc1cc(ccc1OCc1ccccc1Cl)C(c1c(C)n(nH)c1O)c1c(C)n(nH)c1O
InChI=1SC24H25ClN4O4c1432191115(91018(19)331216756817(16)25)22(2013(2)262823(20)30)2114(3)272924(21)31h51122H412H213H3(H2262830)(H2272931)
MFCD03298940
STK052451
ZINC000009012607
ZINC09012607
ZINC9012607

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.