Vitas-M small molecule compound
4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-hydroxy-5-[3-(prop-2-en-1-yloxy)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK819933
SMILES C=CCOc1cccc(c1)C1N(c2sc3c(n2)c(C)cc(c3)C)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
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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 C31H26N2O6S MW 554.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26N2O6S/c1-4-10-37-21-7-5-6-19(15-21)27-25(28(34)20-8-9-22-23(16-20)39-12-11-38-22)29(35)30(36)33(27)31-32-26-18(3)13-17(2)14-24(26)40-31/h4-9,13-16,27,35H,1,10-12H2,2-3H3InChIKey
XMNJAQNYXCVJIG-UHFFFAOYSA-NSynonyms
4(23dihydro14benzodioxin6ylcarbonyl)1(46dimethyl13benzothiazol2yl)3hydroxy5(3(prop2en1yloxy)phenyl)15dihydro2Hpyrrol2one
5(3(allyloxy)phenyl)4(23dihydrobenzo(b)(14)dioxine6carbonyl)1(46dimethylbenzo(d)thiazol2yl)3hydroxy1Hpyrrol2(5H)one
MFCD04028894
ZINC000097967428
ZINC000097967429
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