Vitas-M small molecule compound

4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)phenyl 2,5-dichlorobenzenesulfonate

Catalog ID
STK274996
SMILES O=C1C2C3C=CC(C2C(=O)N1c1ccc(cc1)OS(=O)(=O)c1cc(Cl)ccc1Cl)C3

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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 C21H15Cl2NO5S MW 464.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15Cl2NO5S/c22-13-3-8-16(23)17(10-13)30(27,28)29-15-6-4-14(5-7-15)24-20(25)18-11-1-2-12(9-11)19(18)21(24)26/h1-8,10-12,18-19H,9H2
InChIKey
GMQDYIHOAXBONP-UHFFFAOYSA-N
Synonyms

4(13dioxo133a477ahexahydro2H47methanoisoindol2yl)phenyl25dichlorobenzenesulfonate
C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC=C(C=C4)OS(=O)(=O)C5=C(C=CC(=C5)Cl)Cl
InChI=1SC21H15Cl2NO5Sc22133816(23)17(1013)30(2728)29156414(5715)2420(25)18111212(911)19(18)21(24)26h1810121819H9H2
MFCD03186519
ZINC000101226674
ZINC000239306154

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Available files

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