Vitas-M small molecule compound
1-[2-(4-methoxybenzyl)-2-methyl-5-(4-methyl-3-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl]ethanone
Catalog ID
STK062877
SMILES COc1ccc(cc1)CC1(C)OC(=NN1C(=O)C)c1ccc(c(c1)[N+](=O)[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 C20H21N3O5 MW 383.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O5/c1-13-5-8-16(11-18(13)23(25)26)19-21-22(14(2)24)20(3,28-19)12-15-6-9-17(27-4)10-7-15/h5-11H,12H2,1-4H3InChIKey
LAOLHNJKEZIXNU-UHFFFAOYSA-NSynonyms
674814-37-01(2((4METHOXYPHENYL)METHYL)2METHYL5(4METHYL3NITROPHENYL)134OXADIAZOL3YL)ETHANONE
1(2(4METHOXYBENZYL)2METHYL5(4METHYL3NITROPHENYL)(134)OXADIAZOL3YL)ETHANONE
1(2(4METHOXYBENZYL)2METHYL5(4METHYL3NITROPHENYL)134OXADIAZOL3(2H)YL)ETHANONE
674814370
CC1=C(C=C(C=C1)C2=NN(C(O2)(C)CC3=CC=C(C=C3)OC)C(=O)C)(N+)(=O)(O)
COc1ccc(cc1)CC1(C)OC(=NN1C(=O)C)c1ccc(c(c1)(N+)(=O)(O))C
InChI=1SC20H21N3O5c1135816(1118(13)23(25)26)192122(14(2)24)20(32819)12156917(274)10715h511H12H214H3
MFCD03827848
STK062877
ZINC000001313219
ZINC000001313220
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