Vitas-M small molecule compound
[4-(2,6-dichlorobenzyl)piperazin-1-yl]{5-methyl-4-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2-oxazol-3-yl}methanone
Catalog ID
STL401795
SMILES O=C(c1noc(c1Cn1ncc(c1)[N+](=O)[O-])C)N1CCN(CC1)Cc1c(Cl)cccc1Cl
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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 C20H20Cl2N6O4 MW 479.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20Cl2N6O4/c1-13-15(12-27-10-14(9-23-27)28(30)31)19(24-32-13)20(29)26-7-5-25(6-8-26)11-16-17(21)3-2-4-18(16)22/h2-4,9-10H,5-8,11-12H2,1H3InChIKey
RNTYHSGGTACTRB-UHFFFAOYSA-NSynonyms
1006997-14-3(4((26dichlorophenyl)methyl)piperazin1yl)(5methyl4((4nitropyrazol1yl)methyl)12oxazol3yl)methanone
(4(26dichlorobenzyl)piperazin1yl)(5methyl4((4nitro1Hpyrazol1yl)methyl)12oxazol3yl)methanone
1006997143
CC1=C(C(=NO1)C(=O)N2CCN(CC2)CC3=C(C=CC=C3Cl)Cl)CN4C=C(C=N4)(N+)(=O)(O)
InChI=1SC20H20Cl2N6O4c11315(12271014(92327)28(30)31)19(243213)20(29)267525(6826)111617(21)32418(16)22h24910H581112H21H3
MFCD08554450
O=C(c1noc(c1Cn1ncc(c1)(N+)(=O)(O))C)N1CCN(CC1)Cc1c(Cl)cccc1Cl
ZINC000022715691
ZINC22715691
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