Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-[(4-chloro-3,5-dimethylphenoxy)methyl]-4-methoxyphenyl}methylidene]-5-(3-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STK551419
SMILES COc1ccc(cc1COc1cc(C)c(c(c1)C)Cl)/C=N/NC(=O)c1nnn(c1c1cccc(c1)[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 C28H24ClN9O6 MW 618.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24ClN9O6/c1-15-9-21(10-16(2)23(15)29)43-14-19-11-17(7-8-22(19)42-3)13-31-33-28(39)24-25(18-5-4-6-20(12-18)38(40)41)37(36-32-24)27-26(30)34-44-35-27/h4-13H,14H2,1-3H3,(H2,30,34)(H,33,39)/b31-13+InChIKey
FJVFNGXJGROZPD-IURWMYGYSA-NSynonyms
(E)1(4amino125oxadiazol3yl)N(3((4chloro35dimethylphenoxy)methyl)4methoxybenzylidene)5(3nitrophenyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(3((4chloro35dimethylphenoxy)methyl)4methoxyphenyl)methylidene)5(3nitrophenyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(3((4chloro35dimethylphenoxy)methyl)4methoxyphenyl)methylideneamino)5(3nitrophenyl)triazole4carboxamide
CC1=CC(=CC(=C1Cl)C)OCC2=C(C=CC(=C2)C=NNC(=O)C3=C(N(N=N3)C4=NON=C4N)C5=CC(=CC=C5)(N+)(=O)(O))OC
COc1ccc(cc1COc1cc(C)c(c(c1)C)Cl)C=NNC(=O)c1nnn(c1c1cccc(c1)(N+)(=O)(O))c1nonc1N
InChI=1SC28H24ClN9O6c115921(1016(2)23(15)29)4314191117(7822(19)423)13313328(39)2425(1854620(1218)38(40)41)37(363224)2726(30)34443527h413H14H213H3(H23034)(H3339)b3113+
MFCD03685619
ZINC000102458611
ZINC102458607
Check stock
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Check stock on Vitas-MAvailable files
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