Vitas-M small molecule compound
methyl 4-[({3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-fluorophenyl)-5-oxo-2-thioxoimidazolidin-4-yl}acetyl)amino]benzoate
Catalog ID
STK023278
SMILES COC(=O)c1ccc(cc1)NC(=O)CC1C(=O)N(C(=S)N1CCc1ccc(c(c1)OC)OC)c1ccc(cc1)F
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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 C29H28FN3O6S MW 565.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28FN3O6S/c1-37-24-13-4-18(16-25(24)38-2)14-15-32-23(27(35)33(29(32)40)22-11-7-20(30)8-12-22)17-26(34)31-21-9-5-19(6-10-21)28(36)39-3/h4-13,16,23H,14-15,17H2,1-3H3,(H,31,34)InChIKey
CEUSVTGCWMTOQK-UHFFFAOYSA-NSynonyms
COC(=O)c1ccc(cc1)NC(=O)CC1C(=O)N(C(=S)N1CCc1ccc(c(c1)OC)OC)c1ccc(cc1)F
COC1=C(C=C(C=C1)CCN2C(C(=O)N(C2=S)C3=CC=C(C=C3)F)CC(=O)NC4=CC=C(C=C4)C(=O)OC)OC
InChI=1SC29H28FN3O6Sc1372413418(1625(24)382)14153223(27(35)33(29(32)40)2211720(30)81222)1726(34)31219519(61021)28(36)393h4131623H141517H213H3(H3134)
METHYL4(((3(2(34DIMETHOXYPHENYL)ETHYL)1(4FLUOROPHENYL)5OXO2THIOXOIMIDAZOLIDIN4YL)ACETYL)AMINO)BENZOATE
METHYL4((2(3(2(34DIMETHOXYPHENYL)ETHYL)1(4FLUOROPHENYL)5OXO2SULFANYLIDENEIMIDAZOLIDIN4YL)ACETYL)AMINO)BENZOATE
methyl4(2(3(34dimethoxyphenethyl)1(4fluorophenyl)5oxo2thioxoimidazolidin4yl)acetamido)benzoate
MFCD03285058
STK023278
ZINC000097995503
ZINC000097995504
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.