Vitas-M small molecule compound
4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-hydroxy-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK819972
SMILES CCOc1ccc2c(c1)sc(n2)N1C(c2cccc(c2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)c1ccc2c(c1)OCCO2
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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 C28H21N3O8S MW 559.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21N3O8S/c1-2-37-18-7-8-19-22(14-18)40-28(29-19)30-24(15-4-3-5-17(12-15)31(35)36)23(26(33)27(30)34)25(32)16-6-9-20-21(13-16)39-11-10-38-20/h3-9,12-14,24,33H,2,10-11H2,1H3InChIKey
LBJBLJGVRHKYTR-UHFFFAOYSA-NSynonyms
4(23dihydro14benzodioxin6ylcarbonyl)1(6ethoxy13benzothiazol2yl)3hydroxy5(3nitrophenyl)15dihydro2Hpyrrol2one
4(23dihydrobenzo(b)(14)dioxine6carbonyl)1(6ethoxybenzo(d)thiazol2yl)3hydroxy5(3nitrophenyl)1Hpyrrol2(5H)one
CCOc1ccc2c(c1)sc(n2)N1C(c2cccc(c2)(N+)(=O)(O))C(=C(C1=O)O)C(=O)c1ccc2c(c1)OCCO2
MFCD04009137
ZINC000053306048
ZINC000053306049
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