Vitas-M small molecule compound

methyl 3-[(4-methylbenzyl)sulfamoyl]-1-benzothiophene-2-carboxylate

Catalog ID
STL095956
SMILES COC(=O)c1sc2c(c1S(=O)(=O)NCc1ccc(cc1)C)cccc2

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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 C18H17NO4S2 MW 375.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO4S2/c1-12-7-9-13(10-8-12)11-19-25(21,22)17-14-5-3-4-6-15(14)24-16(17)18(20)23-2/h3-10,19H,11H2,1-2H3
InChIKey
IWTLJYKJGBVTEG-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)CNS(=O)(=O)C2=C(SC3=CC=CC=C32)C(=O)OC
InChI=1SC18H17NO4S2c1127913(10812)111925(2122)1714534615(14)2416(17)18(20)232h31019H11H212H3
METHYL3(((4METHYLBENZYL)AMINO)SULFONYL)1BENZOTHIOPHENE2CARBOXYLATE
methyl3((4methylbenzyl)sulfamoyl)1benzothiophene2carboxylate
methyl3((4methylphenyl)methylsulfamoyl)1benzothiophene2carboxylate
MFCD08140893
ZINC000009646539
ZINC9646539

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Available files

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