Vitas-M small molecule compound
methyl [(5E)-5-{4-[2-nitro-4-(trifluoromethyl)phenoxy]benzylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetate
Catalog ID
STK152268
SMILES COC(=O)CN1C(=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 C20H13F3N2O7S MW 482.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13F3N2O7S/c1-31-17(26)10-24-18(27)16(33-19(24)28)8-11-2-5-13(6-3-11)32-15-7-4-12(20(21,22)23)9-14(15)25(29)30/h2-9H,10H2,1H3/b16-8+InChIKey
MQUQTRSDMJOHST-LZYBPNLTSA-NSynonyms
COC(=O)CN1C(=O)C(=CC2=CC=C(C=C2)OC3=C(C=C(C=C3)C(F)(F)F)(N+)(=O)(O))SC1=O
COC(=O)CN1C(=O)SC(=Cc2ccc(cc2)Oc2ccc(cc2(N+)(=O)(O))C(F)(F)F)C1=O
InChI=1SC20H13F3N2O7Sc13117(26)102418(27)16(3319(24)28)8112513(6311)32157412(20(2122)23)914(15)25(29)30h29H10H21H3b168+
METHYL((5E)5(4(2NITRO4(TRIFLUOROMETHYL)PHENOXY)BENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
METHYL2((5E)5((4(2NITRO4(TRIFLUOROMETHYL)PHENOXY)PHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
METHYL2(5((4(2NITRO4(TRIFLUOROMETHYL)PHENOXY)PHENYL)METHYLENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
MFCD03715555
ZINC000009261157
ZINC09261157
ZINC9261157
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.