Vitas-M small molecule compound
N'-[(E)-{3-ethoxy-4-[(4-methylbenzyl)oxy]phenyl}methylidene]-5-nitro-1-benzofuran-2-carbohydrazide
Catalog ID
STK179464
SMILES CCOc1cc(/C=N/NC(=O)c2cc3c(o2)ccc(c3)[N+](=O)[O-])ccc1OCc1ccc(cc1)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 C26H23N3O6 MW 473.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N3O6/c1-3-33-24-12-19(8-10-23(24)34-16-18-6-4-17(2)5-7-18)15-27-28-26(30)25-14-20-13-21(29(31)32)9-11-22(20)35-25/h4-15H,3,16H2,1-2H3,(H,28,30)/b27-15+InChIKey
LGDCWGPESYDDSE-JFLMPSFJSA-NSynonyms
CCOC1=C(C=CC(=C1)C=NNC(=O)C2=CC3=C(O2)C=CC(=C3)(N+)(=O)(O))OCC4=CC=C(C=C4)C
CCOc1cc(C=NNC(=O)c2cc3c(o2)ccc(c3)(N+)(=O)(O))ccc1OCc1ccc(cc1)C
InChI=1SC26H23N3O6c1333241219(81023(24)3416186417(2)5718)15272826(30)2514201321(29(31)32)91122(20)3525h415H316H212H3(H2830)b2715+
MFCD03239542
N((E)(3ETHOXY4((4METHYLBENZYL)OXY)PHENYL)METHYLIDENE)5NITRO1BENZOFURAN2CARBOHYDRAZIDE
N((E)(3ethoxy4((4methylphenyl)methoxy)phenyl)methylideneamino)5nitro1benzofuran2carboxamide
ZINC000009324174
ZINC96838653
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