Vitas-M small molecule compound

methyl 5-chloro-2-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]benzoate

Catalog ID
STL286927
SMILES COC(=O)c1cc(Cl)ccc1NC1=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/c1-22-15(19)11-8-9(16)6-7-12(11)17-14-10-4-2-3-5-13(10)23(20,21)18-14/h2-8H,1H3,(H,17,18)
InChIKey
RSJQKNDWZOZMSG-UHFFFAOYSA-N
Synonyms
312274-04-7
312274047
COC(=O)C1=C(C=CC(=C1)Cl)NC2=NS(=O)(=O)C3=CC=CC=C32
InChI=1SC15H11ClN2O4Sc12215(19)1189(16)6712(11)171410423513(10)23(2021)1814h28H1H3(H1718)
METHYL2((11DIOXOBENZO(D)12THIAZOLIN3YL)AMINO)5CHLOROBENZOATE
methyl5chloro2((11dioxido12benzothiazol3yl)amino)benzoate
METHYL5CHLORO2((11DIOXO12BENZOTHIAZOL3YL)AMINO)BENZOATE
MFCD01204226
ZINC000002970589
ZINC02970589
ZINC2970589

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Available files

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