Vitas-M small molecule compound
(5E)-5-(3-ethoxy-4-hydroxy-5-nitrobenzylidene)-3-(2-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Catalog ID
STL357960
SMILES CCOc1cc(/C=C\2/SC(=O)N(C2=O)Cc2ccccc2[N+](=O)[O-])cc(c1O)[N+](=O)[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 C19H15N3O8S MW 445.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N3O8S/c1-2-30-15-8-11(7-14(17(15)23)22(28)29)9-16-18(24)20(19(25)31-16)10-12-5-3-4-6-13(12)21(26)27/h3-9,23H,2,10H2,1H3/b16-9+InChIKey
DBKCLJXIGNPYIN-CXUHLZMHSA-NSynonyms
(5E)5((3ETHOXY4HYDROXY5NITROPHENYL)METHYLIDENE)3((2NITROPHENYL)METHYL)13THIAZOLIDINE24DIONE
(5E)5(3ethoxy4hydroxy5nitrobenzylidene)3(2nitrobenzyl)13thiazolidine24dione
CCOC1=CC(=CC(=C1O)(N+)(=O)(O))C=C2C(=O)N(C(=O)S2)CC3=CC=CC=C3(N+)(=O)(O)
CCOc1cc(C=C2SC(=O)N(C2=O)Cc2ccccc2(N+)(=O)(O))cc(c1O)(N+)(=O)(O)
InChI=1SC19H15N3O8Sc123015811(714(17(15)23)22(28)29)91618(24)20(19(25)3116)1012534613(12)21(26)27h3923H210H21H3b169+
MFCD04084872
ZINC000037342275
ZINC37342275
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