Vitas-M small molecule compound
(5Z)-5-{4-[(2-fluorobenzyl)oxy]-3-iodo-5-methoxybenzylidene}-3-(4-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Catalog ID
STL372069
SMILES COc1cc(/C=C/2\SC(=O)N(C2=O)Cc2ccc(cc2)[N+](=O)[O-])cc(c1OCc1ccccc1F)I
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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 C25H18FIN2O6S MW 620.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18FIN2O6S/c1-34-21-11-16(10-20(27)23(21)35-14-17-4-2-3-5-19(17)26)12-22-24(30)28(25(31)36-22)13-15-6-8-18(9-7-15)29(32)33/h2-12H,13-14H2,1H3/b22-12-InChIKey
OTSWGEXAPSKEOH-UUYOSTAYSA-NSynonyms
(5Z)5((4((2FLUOROPHENYL)METHOXY)3IODO5METHOXYPHENYL)METHYLIDENE)3((4NITROPHENYL)METHYL)13THIAZOLIDINE24DIONE
(5Z)5(4((2fluorobenzyl)oxy)3iodo5methoxybenzylidene)3(4nitrobenzyl)13thiazolidine24dione
COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=O)S2)CC3=CC=C(C=C3)(N+)(=O)(O))I)OCC4=CC=CC=C4F
COc1cc(C=C2SC(=O)N(C2=O)Cc2ccc(cc2)(N+)(=O)(O))cc(c1OCc1ccccc1F)I
InChI=1SC25H18FIN2O6Sc134211116(1020(27)23(21)351417423519(17)26)122224(30)28(25(31)3622)13156818(9715)29(32)33h212H1314H21H3b2212
MFCD07084849
ZINC000150656091
ZINC150656091
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