Vitas-M small molecule compound
(5E)-3-(4-nitrobenzyl)-5-[3-(trifluoromethyl)benzylidene]-1,3-thiazolidine-2,4-dione
Catalog ID
STK165678
SMILES O=C1S/C(=C/c2cccc(c2)C(F)(F)F)/C(=O)N1Cc1ccc(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 C18H11F3N2O4S MW 408.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11F3N2O4S/c19-18(20,21)13-3-1-2-12(8-13)9-15-16(24)22(17(25)28-15)10-11-4-6-14(7-5-11)23(26)27/h1-9H,10H2/b15-9+InChIKey
DUJLSRWDPHXVMR-OQLLNIDSSA-NSynonyms
(5E)3((4NITROPHENYL)METHYL)5((3(TRIFLUOROMETHYL)PHENYL)METHYLIDENE)13THIAZOLIDINE24DIONE
(5E)3(4NITROBENZYL)5(3(TRIFLUOROMETHYL)BENZYLIDENE)13THIAZOLIDINE24DIONE
C1=CC(=CC(=C1)C(F)(F)F)C=C2C(=O)N(C(=O)S2)CC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC18H11F3N2O4Sc1918(2021)1331212(813)91516(24)22(17(25)2815)10114614(7511)23(26)27h19H10H2b159+
MFCD07065585
O=C1SC(=Cc2cccc(c2)C(F)(F)F)C(=O)N1Cc1ccc(cc1)(N+)(=O)(O)
ZINC000004702423
ZINC04702423
ZINC4702423
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