Vitas-M small molecule compound
(2E)-3-[4-({4-[2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)ethyl]piperazin-1-yl}sulfonyl)phenyl]prop-2-enoic acid
Catalog ID
STL079737
SMILES OC(=O)/C=C/c1ccc(cc1)S(=O)(=O)N1CCN(CC1)CCN1C(=O)C2C(C1=O)C1CC2C=C1
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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 C24H27N3O6S MW 485.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N3O6S/c28-20(29)8-3-16-1-6-19(7-2-16)34(32,33)26-12-9-25(10-13-26)11-14-27-23(30)21-17-4-5-18(15-17)22(21)24(27)31/h1-8,17-18,21-22H,9-15H2,(H,28,29)/b8-3+InChIKey
CSFHSQMAKFKIJO-FPYGCLRLSA-NSynonyms
361366-50-9(2E)3(4((4(2(13dioxo133a477ahexahydro2H47methanoisoindol2yl)ethyl)piperazin1yl)sulfonyl)phenyl)prop2enoicacid
(E)3(4((4(2(13dioxo3a477atetrahydro1H47methanoisoindol2(3H)yl)ethyl)piperazin1yl)sulfonyl)phenyl)acrylicacid
361366509
C1CN(CCN1CCN2C(=O)C3C4CC(C3C2=O)C=C4)S(=O)(=O)C5=CC=C(C=C5)C=CC(=O)O
InChI=1SC24H27N3O6Sc2820(29)83161619(7216)34(3233)2612925(101326)11142723(30)21174518(1517)22(21)24(27)31h1817182122H915H2(H2829)b83+
MFCD01956830
OC(=O)C=Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)CCN1C(=O)C2C(C1=O)C1CC2C=C1
ZINC000100586828
ZINC000105190755
Check stock
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Check stock on Vitas-MAvailable files
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