Vitas-M small molecule compound
(5E)-5-(3-methoxy-4-propoxybenzylidene)-3-(4-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Catalog ID
STL358166
SMILES CCCOc1ccc(cc1OC)/C=C\1/SC(=O)N(C1=O)Cc1ccc(cc1)[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 C21H20N2O6S MW 428.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O6S/c1-3-10-29-17-9-6-15(11-18(17)28-2)12-19-20(24)22(21(25)30-19)13-14-4-7-16(8-5-14)23(26)27/h4-9,11-12H,3,10,13H2,1-2H3/b19-12+InChIKey
OVIOFJSEGFBNDX-XDHOZWIPSA-NSynonyms
(5E)5((3METHOXY4PROPOXYPHENYL)METHYLIDENE)3((4NITROPHENYL)METHYL)13THIAZOLIDINE24DIONE
(5E)5(3methoxy4propoxybenzylidene)3(4nitrobenzyl)13thiazolidine24dione
CCCOC1=C(C=C(C=C1)C=C2C(=O)N(C(=O)S2)CC3=CC=C(C=C3)(N+)(=O)(O))OC
CCCOc1ccc(cc1OC)C=C1SC(=O)N(C1=O)Cc1ccc(cc1)(N+)(=O)(O)
InChI=1SC21H20N2O6Sc131029179615(1118(17)282)121920(24)22(21(25)3019)13144716(8514)23(26)27h491112H31013H212H3b1912+
MFCD04085672
ZINC000003769560
ZINC03769560
ZINC3769560
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