Vitas-M small molecule compound
1-[4-(4-{[3-(2-butoxyphenyl)-1H-pyrazol-5-yl]carbonyl}piperazin-1-yl)phenyl]ethanone
Catalog ID
STL188673
SMILES CCCCOc1ccccc1c1n[nH]c(c1)C(=O)N1CCN(CC1)c1ccc(cc1)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 C26H30N4O3 MW 446.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N4O3/c1-3-4-17-33-25-8-6-5-7-22(25)23-18-24(28-27-23)26(32)30-15-13-29(14-16-30)21-11-9-20(10-12-21)19(2)31/h5-12,18H,3-4,13-17H2,1-2H3,(H,27,28)InChIKey
QTNIEYPFWVURNJ-UHFFFAOYSA-NSynonyms
1(4(4((3(2butoxyphenyl)1Hpyrazol5yl)carbonyl)piperazin1yl)phenyl)ethanone
1(4(4(3(2butoxyphenyl)1Hpyrazole5carbonyl)piperazin1yl)phenyl)ethanone
CCCCOC1=CC=CC=C1C2=NNC(=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C
CCCCOc1ccccc1c1n(nH)c(c1)C(=O)N1CCN(CC1)c1ccc(cc1)C(=O)C
InChI=1SC26H30N4O3c134173325865722(25)231824(282723)26(32)30151329(141630)2111920(101221)19(2)31h51218H341317H212H3(H2728)
MFCD22388726
ZINC000072331270
ZINC72331270
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