Vitas-M small molecule compound

4,4'-[(3-iodo-4,5-dimethoxyphenyl)methanediyl]bis(3-methyl-1H-pyrazol-5-ol)

Catalog ID
STK111036
SMILES COc1c(I)cc(cc1OC)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 C17H19IN4O4 MW 470.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19IN4O4/c1-7-12(16(23)21-19-7)14(13-8(2)20-22-17(13)24)9-5-10(18)15(26-4)11(6-9)25-3/h5-6,14H,1-4H3,(H2,19,21,23)(H2,20,22,24)
InChIKey
DRLBTGJBFONTNJ-UHFFFAOYSA-N
Synonyms

4((3IODO45DIMETHOXYPHENYL)(3METHYL5OXO12DIHYDROPYRAZOL4YL)METHYL)5METHYL12DIHYDROPYRAZOL3ONE
44((3IODO45DIMETHOXYPHENYL)METHANEDIYL)BIS(3METHYL1HPYRAZOL5OL)
CC1=C(C(=O)NN1)C(C2=CC(=C(C(=C2)I)OC)OC)C3=C(NNC3=O)C
COc1c(I)cc(cc1OC)C(c1c(C)n(nH)c1O)c1c(C)n(nH)c1O
InChI=1SC17H19IN4O4c1712(16(23)21197)14(138(2)202217(13)24)9510(18)15(264)11(69)253h5614H14H3(H2192123)(H2202224)
MFCD04127411
ZINC000009763258
ZINC09763258
ZINC9763258

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Available files

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