Vitas-M small molecule compound
ethyl 4-[({3-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-1-phenyl-2-thioxoimidazolidin-4-yl}acetyl)amino]benzoate
Catalog ID
STK080886
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CC1N(CCc2ccc(c(c2)OC)OC)C(=S)N(C1=O)c1ccccc1
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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 C30H31N3O6S MW 561.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31N3O6S/c1-4-39-29(36)21-11-13-22(14-12-21)31-27(34)19-24-28(35)33(23-8-6-5-7-9-23)30(40)32(24)17-16-20-10-15-25(37-2)26(18-20)38-3/h5-15,18,24H,4,16-17,19H2,1-3H3,(H,31,34)InChIKey
YOPVEINALJQPQJ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CCC3=CC(=C(C=C3)OC)OC)C4=CC=CC=C4
CCOC(=O)c1ccc(cc1)NC(=O)CC1N(CCc2ccc(c(c2)OC)OC)C(=S)N(C1=O)c1ccccc1
ETHYL4(((3(2(34DIMETHOXYPHENYL)ETHYL)5OXO1PHENYL2THIOXOIMIDAZOLIDIN4YL)ACETYL)AMINO)BENZOATE
ETHYL4((2(3(2(34DIMETHOXYPHENYL)ETHYL)5OXO1PHENYL2SULFANYLIDENEIMIDAZOLIDIN4YL)ACETYL)AMINO)BENZOATE
ethyl4(2(3(34dimethoxyphenethyl)5oxo1phenyl2thioxoimidazolidin4yl)acetamido)benzoate
InChI=1SC30H31N3O6Sc143929(36)21111322(141221)3127(34)192428(35)33(238657923)30(40)32(24)171620101525(372)26(1820)383h5151824H4161719H213H3(H3134)
MFCD02142111
STK080886
ZINC000097995513
ZINC000097995514
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.