Vitas-M small molecule compound

dimethyl 5-{[(4-methylphenyl)sulfonyl]amino}benzene-1,3-dicarboxylate

Catalog ID
STK028303
SMILES COC(=O)c1cc(cc(c1)C(=O)OC)NS(=O)(=O)c1ccc(cc1)C

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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 C17H17NO6S MW 363.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO6S/c1-11-4-6-15(7-5-11)25(21,22)18-14-9-12(16(19)23-2)8-13(10-14)17(20)24-3/h4-10,18H,1-3H3
InChIKey
OPOIBODIFZEAIF-UHFFFAOYSA-N
Synonyms
149401-93-4
13DIMETHYL5((4METHYLBENZENE)SULFONAMIDO)BENZENE13DICARBOXYLATE
149401934
5(TOLUENE4SULFONYLAMINO)ISOPHTHALICACIDDIMETHYLESTER
CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC
COC(=O)c1cc(cc(c1)C(=O)OC)NS(=O)(=O)c1ccc(cc1)C
DIMETHYL5(((4METHYLPHENYL)SULFONYL)AMINO)BENZENE13DICARBOXYLATE
DIMETHYL5(((4METHYLPHENYL)SULFONYL)AMINO)ISOPHTHALATE
DIMETHYL5((4METHYLPHENYL)SULFONYLAMINO)BENZENE13DICARBOXYLATE
InChI=1SC17H17NO6Sc1114615(7511)25(2122)1814912(16(19)232)813(1014)17(20)243h41018H13H3
METHYL3(METHOXYCARBONYL)5(((4METHYLPHENYL)SULFONYL)AMINO)BENZOATE
MFCD01115680
STK028303
ZINC000000634198
ZINC00634198
ZINC634198

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Available files

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