Vitas-M small molecule compound
[4-(5-chloro-2-methylphenyl)piperazin-1-yl]{5-[(2-fluorophenyl)amino]-1H-1,2,3-triazol-4-yl}methanone
Catalog ID
STL098870
SMILES Clc1ccc(c(c1)N1CCN(CC1)C(=O)c1nn[nH]c1Nc1ccccc1F)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 C20H20ClFN6O MW 414.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClFN6O/c1-13-6-7-14(21)12-17(13)27-8-10-28(11-9-27)20(29)18-19(25-26-24-18)23-16-5-3-2-4-15(16)22/h2-7,12H,8-11H2,1H3,(H2,23,24,25,26)InChIKey
FXXAYKFMROTOAW-UHFFFAOYSA-NSynonyms
1291870-65-9(4(5chloro2methylphenyl)piperazin1yl)(5((2fluorophenyl)amino)1H123triazol4yl)methanone
(4(5chloro2methylphenyl)piperazin1yl)(5(2fluoroanilino)2Htriazol4yl)methanone
1291870659
CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=NNN=C3NC4=CC=CC=C4F
Clc1ccc(c(c1)N1CCN(CC1)C(=O)c1nn(nH)c1Nc1ccccc1F)C
InChI=1SC20H20ClFN6Oc1136714(21)1217(13)2781028(11927)20(29)1819(25262418)2316532415(16)22h2712H811H21H3(H223242526)
MFCD18790113
ZINC000067284450
ZINC67284450
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