Vitas-M small molecule compound
(3-{[4-(2-ethoxyphenyl)piperazin-1-yl]sulfonyl}-1-methyl-1H-pyrazol-4-yl)[4-(pyrimidin-2-yl)piperazin-1-yl]methanone
Catalog ID
STL132555
SMILES CCOc1ccccc1N1CCN(CC1)S(=O)(=O)c1nn(cc1C(=O)N1CCN(CC1)c1ncccn1)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 C25H32N8O4S MW 540.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N8O4S/c1-3-37-22-8-5-4-7-21(22)30-15-17-33(18-16-30)38(35,36)23-20(19-29(2)28-23)24(34)31-11-13-32(14-12-31)25-26-9-6-10-27-25/h4-10,19H,3,11-18H2,1-2H3InChIKey
QVHXYFWUHANWIG-UHFFFAOYSA-NSynonyms
(3((4(2ethoxyphenyl)piperazin1yl)sulfonyl)1methyl1Hpyrazol4yl)(4(pyrimidin2yl)piperazin1yl)methanone
(3(4(2ethoxyphenyl)piperazin1yl)sulfonyl1methylpyrazol4yl)(4pyrimidin2ylpiperazin1yl)methanone
CCOC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=NN(C=C3C(=O)N4CCN(CC4)C5=NC=CC=N5)C
InChI=1SC25H32N8O4Sc133722854721(22)30151733(181630)38(3536)2320(1929(2)2823)24(34)31111332(141231)252696102725h41019H31118H212H3
MFCD20752496
ZINC000102920303
ZINC102920303
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