Vitas-M small molecule compound
(5E)-5-({[2-chloro-5-(trifluoromethyl)phenyl]amino}methylidene)-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK991434
SMILES S=C1S/C(=C/Nc2cc(ccc2Cl)C(F)(F)F)/C(=O)N1CC1CCCO1
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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 C16H14ClF3N2O2S2 MW 422.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14ClF3N2O2S2/c17-11-4-3-9(16(18,19)20)6-12(11)21-7-13-14(23)22(15(25)26-13)8-10-2-1-5-24-10/h3-4,6-7,10,21H,1-2,5,8H2/b13-7+InChIKey
KRHHIVVHIGXCFT-NTUHNPAUSA-NSynonyms
(5E)5(((2chloro5(trifluoromethyl)phenyl)amino)methylidene)3(tetrahydrofuran2ylmethyl)2thioxo13thiazolidin4one
(5E)5((2chloro5(trifluoromethyl)anilino)methylidene)3(oxolan2ylmethyl)2sulfanylidene13thiazolidin4one
C1CC(OC1)CN2C(=O)C(=CNC3=C(C=CC(=C3)C(F)(F)F)Cl)SC2=S
InChI=1SC16H14ClF3N2O2S2c1711439(16(1819)20)612(11)2171314(23)22(15(25)2613)8102152410h34671021H1258H2b137+
MFCD07801985
S=C1SC(=CNc2cc(ccc2Cl)C(F)(F)F)C(=O)N1CC1CCCO1
ZINC000008836379
ZINC000008836380
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