Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-bromo-4-fluorophenyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STK673697
SMILES O=C(c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1N)N/N=C/c1ccc(c(c1)Br)F
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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 C18H11BrFN9O4 MW 516.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11BrFN9O4/c19-12-7-9(1-6-13(12)20)8-22-24-18(30)14-15(10-2-4-11(5-3-10)29(31)32)28(27-23-14)17-16(21)25-33-26-17/h1-8H,(H2,21,25)(H,24,30)/b22-8+InChIKey
RNXPMALXDIUZFA-GZIVZEMBSA-NSynonyms
1(4amino125oxadiazol3yl)N((E)(3bromo4fluorophenyl)methylidene)5(4nitrophenyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(3bromo4fluorophenyl)methylideneamino)5(4nitrophenyl)triazole4carboxamide
C1=CC(=CC=C1C2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=CC(=C(C=C4)F)Br)(N+)(=O)(O)
InChI=1SC18H11BrFN9O4c191279(1613(12)20)8222418(30)1415(102411(5310)29(31)32)28(272314)1716(21)25332617h18H(H22125)(H2430)b228+
MFCD01239846
O=C(c1nnn(c1c1ccc(cc1)(N+)(=O)(O))c1nonc1N)NN=Cc1ccc(c(c1)Br)F
ZINC000003664264
ZINC64256531
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