Vitas-M small molecule compound
ethyl 2-{3-hydroxy-4-[(4-methylphenyl)carbonyl]-5-(3-nitrophenyl)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK822918
SMILES CCOC(=O)c1sc(nc1C)N1C(c2cccc(c2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)c1ccc(cc1)C
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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 C25H21N3O7S MW 507.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O7S/c1-4-35-24(32)22-14(3)26-25(36-22)27-19(16-6-5-7-17(12-16)28(33)34)18(21(30)23(27)31)20(29)15-10-8-13(2)9-11-15/h5-12,19,30H,4H2,1-3H3InChIKey
ZHOQWUJKCAJZOM-UHFFFAOYSA-NSynonyms
CCOC(=O)c1sc(nc1C)N1C(c2cccc(c2)(N+)(=O)(O))C(=C(C1=O)O)C(=O)c1ccc(cc1)C
ethyl2(3hydroxy4((4methylphenyl)carbonyl)5(3nitrophenyl)2oxo25dihydro1Hpyrrol1yl)4methyl13thiazole5carboxylate
MFCD03284545
ZINC000005355857
ZINC000005355864
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