Vitas-M small molecule compound
(5Z)-5-{4-[2-nitro-4-(trifluoromethyl)phenoxy]benzylidene}-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione
Catalog ID
STK152477
SMILES C#CCN1C(=O)S/C(=C\c2ccc(cc2)Oc2ccc(cc2[N+](=O)[O-])C(F)(F)F)/C1=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 C20H11F3N2O5S MW 448.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H11F3N2O5S/c1-2-9-24-18(26)17(31-19(24)27)10-12-3-6-14(7-4-12)30-16-8-5-13(20(21,22)23)11-15(16)25(28)29/h1,3-8,10-11H,9H2/b17-10-InChIKey
IEKMDENAYOCECQ-YVLHZVERSA-NSynonyms
(5Z)5((4(2NITRO4(TRIFLUOROMETHYL)PHENOXY)PHENYL)METHYLIDENE)3PROP2YNYL13THIAZOLIDINE24DIONE
(5Z)5(4(2NITRO4(TRIFLUOROMETHYL)PHENOXY)BENZYLIDENE)3(PROP2YN1YL)13THIAZOLIDINE24DIONE
C#CCN1C(=O)C(=CC2=CC=C(C=C2)OC3=C(C=C(C=C3)C(F)(F)F)(N+)(=O)(O))SC1=O
C#CCN1C(=O)SC(=Cc2ccc(cc2)Oc2ccc(cc2(N+)(=O)(O))C(F)(F)F)C1=O
InChI=1SC20H11F3N2O5Sc1292418(26)17(3119(24)27)10123614(7412)30168513(20(2122)23)1115(16)25(28)29h1381011H9H2b1710
MFCD06662888
ZINC000001143360
ZINC01143360
ZINC1143360
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