Vitas-M small molecule compound

ethyl 4-{[(3-methyl-2-oxo-2,3-dihydro-1,3-benzothiazol-6-yl)sulfonyl]amino}benzoate

Catalog ID
STK777398
SMILES CCOC(=O)c1ccc(cc1)NS(=O)(=O)c1ccc2c(c1)sc(=O)n2C

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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 C17H16N2O5S2 MW 392.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O5S2/c1-3-24-16(20)11-4-6-12(7-5-11)18-26(22,23)13-8-9-14-15(10-13)25-17(21)19(14)2/h4-10,18H,3H2,1-2H3
InChIKey
NBYGNZVICABQMO-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)S3)C
ethyl4(((3methyl2oxo23dihydro13benzothiazol6yl)sulfonyl)amino)benzoate
ETHYL4((3METHYL2OXO13BENZOTHIAZOL6YL)SULFONYLAMINO)BENZOATE
InChI=1SC17H16N2O5S2c132416(20)114612(7511)1826(2223)13891415(1013)2517(21)19(14)2h41018H3H212H3
MFCD05260458
ZINC000001425221
ZINC01425221
ZINC1425221

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Available files

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