Vitas-M small molecule compound

2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-{(E)-[5-(4-methoxy-2-nitrophenyl)furan-2-yl]methylidene}acetohydrazide

Catalog ID
STK263976
SMILES COc1ccc(c(c1)[N+](=O)[O-])c1ccc(o1)/C=N/NC(=O)Cc1ccc2c(c1)OCCO2

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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 C22H19N3O7 MW 437.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O7/c1-29-15-3-5-17(18(12-15)25(27)28)19-7-4-16(32-19)13-23-24-22(26)11-14-2-6-20-21(10-14)31-9-8-30-20/h2-7,10,12-13H,8-9,11H2,1H3,(H,24,26)/b23-13+
InChIKey
CNMAGIXOCVGKCN-YDZHTSKRSA-N
Synonyms

2(23DIHYDRO14BENZODIOXIN6YL)N((E)(5(4METHOXY2NITROPHENYL)FURAN2YL)METHYLIDENE)ACETOHYDRAZIDE
2(23dihydro14benzodioxin6yl)N((E)(5(4methoxy2nitrophenyl)furan2yl)methylideneamino)acetamide
COC1=CC(=C(C=C1)C2=CC=C(O2)C=NNC(=O)CC3=CC4=C(C=C3)OCCO4)(N+)(=O)(O)
COc1ccc(c(c1)(N+)(=O)(O))c1ccc(o1)C=NNC(=O)Cc1ccc2c(c1)OCCO2
InChI=1SC22H19N3O7c129153517(18(1215)25(27)28)197416(3219)13232422(26)1114262021(1014)31983020h27101213H8911H21H3(H2426)b2313+
MFCD05823918
ZINC000009480678
ZINC33504785

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.