Vitas-M small molecule compound
(5Z)-5-{3-[(2-chloro-5-fluoropyrimidin-4-yl)oxy]benzylidene}-3-(3,4-dimethylphenyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL419220
SMILES S=C1S/C(=C\c2cccc(c2)Oc2nc(Cl)ncc2F)/C(=O)N1c1ccc(c(c1)C)C
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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 C22H15ClFN3O2S2 MW 471.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15ClFN3O2S2/c1-12-6-7-15(8-13(12)2)27-20(28)18(31-22(27)30)10-14-4-3-5-16(9-14)29-19-17(24)11-25-21(23)26-19/h3-11H,1-2H3/b18-10-InChIKey
VUVDWYLTXXYGGX-ZDLGFXPLSA-NSynonyms
(5Z)5((3(2chloro5fluoropyrimidin4yl)oxyphenyl)methylidene)3(34dimethylphenyl)2sulfanylidene13thiazolidin4one
(5Z)5(3((2chloro5fluoropyrimidin4yl)oxy)benzylidene)3(34dimethylphenyl)2thioxo13thiazolidin4one
CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC(=CC=C3)OC4=NC(=NC=C4F)Cl)SC2=S)C
InChI=1SC22H15ClFN3O2S2c1126715(813(12)2)2720(28)18(3122(27)30)101443516(914)291917(24)112521(23)2619h311H12H3b1810
MFCD30707304
S=C1SC(=Cc2cccc(c2)Oc2nc(Cl)ncc2F)C(=O)N1c1ccc(c(c1)C)C
ZINC000001890288
ZINC1890288
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