Vitas-M small molecule compound

N-benzyl-4,5-dimethoxy-2-nitro-N-(pyridin-2-yl)benzamide

Catalog ID
STK026595
SMILES COc1cc(c(cc1OC)[N+](=O)[O-])C(=O)N(c1ccccn1)Cc1ccccc1

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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 C21H19N3O5 MW 393.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O5/c1-28-18-12-16(17(24(26)27)13-19(18)29-2)21(25)23(20-10-6-7-11-22-20)14-15-8-4-3-5-9-15/h3-13H,14H2,1-2H3
InChIKey
LESVCSZYAFVPTD-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C(=C1)C(=O)N(CC2=CC=CC=C2)C3=CC=CC=N3)(N+)(=O)(O))OC
COc1cc(c(cc1OC)(N+)(=O)(O))C(=O)N(c1ccccn1)Cc1ccccc1
InChI=1SC21H19N3O5c128181216(17(24(26)27)1319(18)292)21(25)23(201067112220)14158435915h313H14H212H3
MFCD02633546
NBENZYL45DIMETHOXY2NITRON(PYRIDIN2YL)BENZAMIDE
NBENZYL45DIMETHOXY2NITRONPYRIDIN2YLBENZAMIDE
STK026595
ZINC000004562021
ZINC04562021
ZINC4562021

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Available files

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