Vitas-M small molecule compound

4-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]phenyl chloroacetate

Catalog ID
STK386157
SMILES ClCC(=O)Oc1ccc(cc1)NC1=NS(=O)(=O)c2c1cccc2

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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 C15H11ClN2O4S MW 350.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11ClN2O4S/c16-9-14(19)22-11-7-5-10(6-8-11)17-15-12-3-1-2-4-13(12)23(20,21)18-15/h1-8H,9H2,(H,17,18)
InChIKey
GRNMJWAEXBUPRS-UHFFFAOYSA-N
Synonyms

(4((11DIOXO12BENZOTHIAZOL3YL)AMINO)PHENYL)2CHLOROACETATE
4((11dioxido12benzothiazol3yl)amino)phenylchloroacetate
4((11DIOXOBENZO(D)12THIAZOLIN3YL)AMINO)PHENYL2CHLOROACETATE
C1=CC=C2C(=C1)C(=NS2(=O)=O)NC3=CC=C(C=C3)OC(=O)CCl
InChI=1SC15H11ClN2O4Sc16914(19)22117510(6811)171512312413(12)23(2021)1815h18H9H2(H1718)
MFCD02067444
ZINC000004064313
ZINC04064313
ZINC4064313

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Available files

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