Vitas-M small molecule compound

2-[(2-chlorophenyl)(1,1-dioxido-1,2-benzothiazol-3-yl)amino]ethyl pyridine-4-carboxylate

Catalog ID
STK138559
SMILES O=C(c1ccncc1)OCCN(C1=NS(=O)(=O)c2c1cccc2)c1ccccc1Cl

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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 C21H16ClN3O4S MW 441.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClN3O4S/c22-17-6-2-3-7-18(17)25(13-14-29-21(26)15-9-11-23-12-10-15)20-16-5-1-4-8-19(16)30(27,28)24-20/h1-12H,13-14H2
InChIKey
LZEQLCFQKAWLOE-UHFFFAOYSA-N
Synonyms

2((2CHLOROPHENYL)(11DIOXIDO12BENZOTHIAZOL3YL)AMINO)ETHYLPYRIDINE4CARBOXYLATE
2(2CHLORON(11DIOXO12BENZOTHIAZOL3YL)ANILINO)ETHYLPYRIDINE4CARBOXYLATE
C1=CC=C2C(=C1)C(=NS2(=O)=O)N(CCOC(=O)C3=CC=NC=C3)C4=CC=CC=C4Cl
InChI=1SC21H16ClN3O4Sc2217623718(17)25(13142921(26)1591123121015)2016514819(16)30(2728)2420h112H1314H2
MFCD03719867
ZINC000002488265
ZINC02488265
ZINC2488265

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Available files

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