Vitas-M small molecule compound

dimethyl 2-({[4-(acetylamino)phenyl]sulfonyl}amino)benzene-1,4-dicarboxylate

Catalog ID
STK097586
SMILES COC(=O)c1ccc(cc1NS(=O)(=O)c1ccc(cc1)NC(=O)C)C(=O)OC

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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 C18H18N2O7S MW 406.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O7S/c1-11(21)19-13-5-7-14(8-6-13)28(24,25)20-16-10-12(17(22)26-2)4-9-15(16)18(23)27-3/h4-10,20H,1-3H3,(H,19,21)
InChIKey
HETVLTBVYUMISG-UHFFFAOYSA-N
Synonyms
330468-77-4
14DIMETHYL2((4ACETAMIDOBENZENE)SULFONAMIDO)BENZENE14DICARBOXYLATE
2(4ACETYLAMINOBENZENESULFONYLAMINO)TEREPHTHALICACIDDIMETHYLESTER
330468774
CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC
COC(=O)c1ccc(cc1NS(=O)(=O)c1ccc(cc1)NC(=O)C)C(=O)OC
DIMETHYL2(((4(ACETYLAMINO)PHENYL)SULFONYL)AMINO)BENZENE14DICARBOXYLATE
DIMETHYL2((4ACETAMIDOPHENYL)SULFONYLAMINO)BENZENE14DICARBOXYLATE
InChI=1SC18H18N2O7Sc111(21)19135714(8613)28(2425)20161012(17(22)262)4915(16)18(23)273h41020H13H3(H1921)
METHYL3(((4(ACETYLAMINO)PHENYL)SULFONYL)AMINO)4(METHOXYCARBONYL)BENZOATE
MFCD01115731
STK097586
ZINC000003876416
ZINC3876416

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Available files

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