Vitas-M small molecule compound

N-(3,4-dimethoxyphenyl)-4-methyl-3-nitrobenzenesulfonamide

Catalog ID
STL137652
SMILES COc1cc(ccc1OC)NS(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])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 C15H16N2O6S MW 352.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N2O6S/c1-10-4-6-12(9-13(10)17(18)19)24(20,21)16-11-5-7-14(22-2)15(8-11)23-3/h4-9,16H,1-3H3
InChIKey
GXDHRWRUALKCCD-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)OC)OC)(N+)(=O)(O)
COc1cc(ccc1OC)NS(=O)(=O)c1ccc(c(c1)(N+)(=O)(O))C
InChI=1SC15H16N2O6Sc1104612(913(10)17(18)19)24(2021)16115714(222)15(811)233h4916H13H3
MFCD00752838
N(34dimethoxyphenyl)4methyl3nitrobenzenesulfonamide
ZINC000005126772
ZINC05126772
ZINC5126772

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Available files

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