Vitas-M small molecule compound

[3-(4-butoxyphenyl)-1H-pyrazol-5-yl][4-(pyrimidin-2-yl)piperazin-1-yl]methanone

Catalog ID
STL188652
SMILES CCCCOc1ccc(cc1)c1n[nH]c(c1)C(=O)N1CCN(CC1)c1ncccn1

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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 C22H26N6O2 MW 406.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N6O2/c1-2-3-15-30-18-7-5-17(6-8-18)19-16-20(26-25-19)21(29)27-11-13-28(14-12-27)22-23-9-4-10-24-22/h4-10,16H,2-3,11-15H2,1H3,(H,25,26)
InChIKey
YPABJDDQYTYLJL-UHFFFAOYSA-N
Synonyms

(3(4butoxyphenyl)1Hpyrazol5yl)(4(pyrimidin2yl)piperazin1yl)methanone
(3(4butoxyphenyl)1Hpyrazol5yl)(4pyrimidin2ylpiperazin1yl)methanone
CCCCOC1=CC=C(C=C1)C2=NNC(=C2)C(=O)N3CCN(CC3)C4=NC=CC=N4
CCCCOc1ccc(cc1)c1n(nH)c(c1)C(=O)N1CCN(CC1)c1ncccn1
InChI=1SC22H26N6O2c1231530187517(6818)191620(262519)21(29)27111328(141227)222394102422h41016H231115H21H3(H2526)
MFCD22388705
ZINC000072331254
ZINC72331254

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Available files

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