Vitas-M small molecule compound
(5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-2-thioxo-5-({[3-(trifluoromethyl)phenyl]amino}methylidene)-1,3-thiazolidin-4-one
Catalog ID
STK991431
SMILES COc1cc(CCN2C(=S)S/C(=C/Nc3cccc(c3)C(F)(F)F)/C2=O)ccc1OC
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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 C21H19F3N2O3S2 MW 468.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19F3N2O3S2/c1-28-16-7-6-13(10-17(16)29-2)8-9-26-19(27)18(31-20(26)30)12-25-15-5-3-4-14(11-15)21(22,23)24/h3-7,10-12,25H,8-9H2,1-2H3/b18-12+InChIKey
PRCZMYQKWCEKOV-LDADJPATSA-NSynonyms
(5E)3(2(34dimethoxyphenyl)ethyl)2sulfanylidene5((3(trifluoromethyl)anilino)methylidene)13thiazolidin4one
(5E)3(2(34dimethoxyphenyl)ethyl)2thioxo5(((3(trifluoromethyl)phenyl)amino)methylidene)13thiazolidin4one
COC1=C(C=C(C=C1)CCN2C(=O)C(=CNC3=CC=CC(=C3)C(F)(F)F)SC2=S)OC
COc1cc(CCN2C(=S)SC(=CNc3cccc(c3)C(F)(F)F)C2=O)ccc1OC
InChI=1SC21H19F3N2O3S2c128167613(1017(16)292)892619(27)18(3120(26)30)12251553414(1115)21(2223)24h37101225H89H212H3b1812+
MFCD07801980
ZINC000102819561
ZINC06151013
ZINC102819561
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