Vitas-M small molecule compound

2-[(2-chlorophenyl)(1,1-dioxido-1,2-benzothiazol-3-yl)amino]ethyl benzoate

Catalog ID
STL286912
SMILES Clc1ccccc1N(C1=NS(=O)(=O)c2c1cccc2)CCOC(=O)c1ccccc1

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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 C22H17ClN2O4S MW 440.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17ClN2O4S/c23-18-11-5-6-12-19(18)25(14-15-29-22(26)16-8-2-1-3-9-16)21-17-10-4-7-13-20(17)30(27,28)24-21/h1-13H,14-15H2
InChIKey
OUKPYZZDQYKTEV-UHFFFAOYSA-N
Synonyms

2((2chlorophenyl)(11dioxido12benzothiazol3yl)amino)ethylbenzoate
2(2CHLORON(11DIOXO12BENZOTHIAZOL3YL)ANILINO)ETHYLBENZOATE
C1=CC=C(C=C1)C(=O)OCCN(C2=CC=CC=C2Cl)C3=NS(=O)(=O)C4=CC=CC=C43
InChI=1SC22H17ClN2O4Sc231811561219(18)25(14152922(26)168213916)211710471320(17)30(2728)2421h113H1415H2
MFCD01234988
ZINC000000848941
ZINC00848941
ZINC848941

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Available files

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