Vitas-M small molecule compound

5,5'-sulfonylbis[2-(3-hydroxypropyl)-1H-isoindole-1,3(2H)-dione]

Catalog ID
STK018294
SMILES OCCCN1C(=O)c2c(C1=O)cc(cc2)S(=O)(=O)c1ccc2c(c1)C(=O)N(C2=O)CCCO

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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 C22H20N2O8S MW 472.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O8S/c25-9-1-7-23-19(27)15-5-3-13(11-17(15)21(23)29)33(31,32)14-4-6-16-18(12-14)22(30)24(20(16)28)8-2-10-26/h3-6,11-12,25-26H,1-2,7-10H2
InChIKey
XMVGJZFMJXMILH-UHFFFAOYSA-N
Synonyms

2(3HYDROXYPROPYL)5(2(3HYDROXYPROPYL)13DIOXOISOINDOL5YL)SULFONYLISOINDOLE13DIONE
55SULFONYLBIS(2(3HYDROXYPROPYL)1HISOINDOLE13(2H)DIONE)
C1=CC2=C(C=C1S(=O)(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CCCO)C(=O)N(C2=O)CCCO
InChI=1SC22H20N2O8Sc259172319(27)155313(1117(15)21(23)29)33(3132)14461618(1214)22(30)24(20(16)28)821026h3611122526H12710H2
MFCD02031796
OCCCN1C(=O)c2c(C1=O)cc(cc2)S(=O)(=O)c1ccc2c(c1)C(=O)N(C2=O)CCCO
STK018294
ZINC000008993712
ZINC08993712
ZINC8993712

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Available files

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