Vitas-M small molecule compound
[3-(2-butoxyphenyl)-1H-pyrazol-5-yl][4-(5-chloro-2-methylphenyl)piperazin-1-yl]methanone
Catalog ID
STL188672
SMILES CCCCOc1ccccc1c1n[nH]c(c1)C(=O)N1CCN(CC1)c1cc(Cl)ccc1C
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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 C25H29ClN4O2 MW 452.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29ClN4O2/c1-3-4-15-32-24-8-6-5-7-20(24)21-17-22(28-27-21)25(31)30-13-11-29(12-14-30)23-16-19(26)10-9-18(23)2/h5-10,16-17H,3-4,11-15H2,1-2H3,(H,27,28)InChIKey
AIXCTWSEGBTHHF-UHFFFAOYSA-NSynonyms
(3(2butoxyphenyl)1Hpyrazol5yl)(4(5chloro2methylphenyl)piperazin1yl)methanone
CCCCOC1=CC=CC=C1C2=NNC(=C2)C(=O)N3CCN(CC3)C4=C(C=CC(=C4)Cl)C
CCCCOc1ccccc1c1n(nH)c(c1)C(=O)N1CCN(CC1)c1cc(Cl)ccc1C
InChI=1SC25H29ClN4O2c134153224865720(24)211722(282721)25(31)30131129(121430)231619(26)10918(23)2h5101617H341115H212H3(H2728)
MFCD22388725
ZINC000072331269
ZINC72331269
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