Vitas-M small molecule compound

N-(2,4-dimethylpentan-3-yl)-2-nitrobenzenesulfonamide

Catalog ID
STL137333
SMILES CC(C(C(C)C)NS(=O)(=O)c1ccccc1[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 C13H20N2O4S MW 300.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H20N2O4S/c1-9(2)13(10(3)4)14-20(18,19)12-8-6-5-7-11(12)15(16)17/h5-10,13-14H,1-4H3
InChIKey
FJKRODFOJPAOJT-UHFFFAOYSA-N
Synonyms

CC(C(C(C)C)NS(=O)(=O)c1ccccc1(N+)(=O)(O))C
CC(C)C(C(C)C)NS(=O)(=O)C1=CC=CC=C1(N+)(=O)(O)
InChI=1SC13H20N2O4Sc19(2)13(10(3)4)1420(1819)12865711(12)15(16)17h5101314H14H3
MFCD03136696
N(24dimethylpentan3yl)2nitrobenzenesulfonamide
ZINC000000450377
ZINC00450377
ZINC450377

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Available files

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