Vitas-M small molecule compound
2-[2-(4-{[(E)-2-phenylethenyl]sulfonyl}piperazin-1-yl)ethyl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Catalog ID
STL079739
SMILES O=C1C2C3C=CC(C2C(=O)N1CCN1CCN(CC1)S(=O)(=O)/C=C/c1ccccc1)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 C23H27N3O4S MW 441.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O4S/c27-22-20-18-6-7-19(16-18)21(20)23(28)26(22)14-11-24-9-12-25(13-10-24)31(29,30)15-8-17-4-2-1-3-5-17/h1-8,15,18-21H,9-14,16H2/b15-8+InChIKey
CZWYSKQUGLIDLE-OVCLIPMQSA-NSynonyms
361366-53-2(E)2(2(4(styrylsulfonyl)piperazin1yl)ethyl)3a477atetrahydro1H47methanoisoindole13(2H)dione
2(2(4(((E)2phenylethenyl)sulfonyl)piperazin1yl)ethyl)3a477atetrahydro1H47methanoisoindole13(2H)dione
361366532
C1CN(CCN1CCN2C(=O)C3C4CC(C3C2=O)C=C4)S(=O)(=O)C=CC5=CC=CC=C5
InChI=1SC23H27N3O4Sc272220186719(1618)21(20)23(28)26(22)14112491225(131024)31(2930)158174213517h18151821H91416H2b158+
MFCD01955651
O=C1C2C3C=CC(C2C(=O)N1CCN1CCN(CC1)S(=O)(=O)C=Cc1ccccc1)C3
ZINC000100586860
ZINC000245231468
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