Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-[(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STK662518
SMILES COc1ccc(cc1Cn1nc(c(c1C)Br)[N+](=O)[O-])/C=N/NC(=O)c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1N
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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 C24H19BrN12O7 MW 667.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19BrN12O7/c1-12-18(25)22(37(41)42)30-34(12)11-15-9-13(3-8-17(15)43-2)10-27-29-24(38)19-20(14-4-6-16(7-5-14)36(39)40)35(33-28-19)23-21(26)31-44-32-23/h3-10H,11H2,1-2H3,(H2,26,31)(H,29,38)/b27-10+InChIKey
MASRJJJHHHVNOD-YPXUMCKCSA-NSynonyms
(E)1(4amino125oxadiazol3yl)N(3((4bromo5methyl3nitro1Hpyrazol1yl)methyl)4methoxybenzylidene)5(4nitrophenyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(3((4bromo5methyl3nitro1Hpyrazol1yl)methyl)4methoxyphenyl)methylidene)5(4nitrophenyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(3((4bromo5methyl3nitropyrazol1yl)methyl)4methoxyphenyl)methylideneamino)5(4nitrophenyl)triazole4carboxamide
CC1=C(C(=NN1CC2=C(C=CC(=C2)C=NNC(=O)C3=C(N(N=N3)C4=NON=C4N)C5=CC=C(C=C5)(N+)(=O)(O))OC)(N+)(=O)(O))Br
COc1ccc(cc1Cn1nc(c(c1C)Br)(N+)(=O)(O))C=NNC(=O)c1nnn(c1c1ccc(cc1)(N+)(=O)(O))c1nonc1N
InChI=1SC24H19BrN12O7c11218(25)22(37(41)42)3034(12)1115913(3817(15)432)10272924(38)1920(144616(7514)36(39)40)35(332819)2321(26)31443223h310H11H212H3(H22631)(H2938)b2710+
MFCD01821961
ZINC000150365465
ZINC150467991
Check stock
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