Vitas-M small molecule compound
2-(1,3-benzodioxol-5-yl)-N'-[(E)-{3-ethoxy-4-[(4-nitrobenzyl)oxy]phenyl}methylidene]acetohydrazide
Catalog ID
STL387116
SMILES CCOc1cc(/C=N/NC(=O)Cc2ccc3c(c2)OCO3)ccc1OCc1ccc(cc1)[N+](=O)[O-]
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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 C25H23N3O7 MW 477.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O7/c1-2-32-23-12-19(6-10-21(23)33-15-17-3-7-20(8-4-17)28(30)31)14-26-27-25(29)13-18-5-9-22-24(11-18)35-16-34-22/h3-12,14H,2,13,15-16H2,1H3,(H,27,29)/b26-14+InChIKey
SNEIZYVHGCETMH-VULFUBBASA-NSynonyms
2(13benzodioxol5yl)N((E)(3ethoxy4((4nitrobenzyl)oxy)phenyl)methylidene)acetohydrazide
2(13benzodioxol5yl)N((E)(3ethoxy4((4nitrophenyl)methoxy)phenyl)methylideneamino)acetamide
CCOC1=C(C=CC(=C1)C=NNC(=O)CC2=CC3=C(C=C2)OCO3)OCC4=CC=C(C=C4)(N+)(=O)(O)
CCOc1cc(C=NNC(=O)Cc2ccc3c(c2)OCO3)ccc1OCc1ccc(cc1)(N+)(=O)(O)
InChI=1SC25H23N3O7c1232231219(61021(23)3315173720(8417)28(30)31)14262725(29)1318592224(1118)35163422h31214H2131516H21H3(H2729)b2614+
MFCD03013502
N((1E)2(3ETHOXY4((4NITROPHENYL)METHOXY)PHENYL)1AZAVINYL)2(2HBENZO(34D)13DIOXOLEN5YL)ACETAMIDE
ZINC000016689105
ZINC33761676
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