Vitas-M small molecule compound
methyl 4-[({3-[2-(3,4-diethoxyphenyl)ethyl]-1-(4-fluorophenyl)-5-oxo-2-thioxoimidazolidin-4-yl}acetyl)amino]benzoate
Catalog ID
STK678387
SMILES CCOc1cc(CCN2C(=S)N(C(=O)C2CC(=O)Nc2ccc(cc2)C(=O)OC)c2ccc(cc2)F)ccc1OCC
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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 C31H32FN3O6S MW 593.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32FN3O6S/c1-4-40-26-15-6-20(18-27(26)41-5-2)16-17-34-25(29(37)35(31(34)42)24-13-9-22(32)10-14-24)19-28(36)33-23-11-7-21(8-12-23)30(38)39-3/h6-15,18,25H,4-5,16-17,19H2,1-3H3,(H,33,36)InChIKey
QMTMATJPKVOVMO-UHFFFAOYSA-NSynonyms
CCOC1=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)OCC
InChI=1SC31H32FN3O6Sc14402615620(1827(26)4152)16173425(29(37)35(31(34)42)2413922(32)101424)1928(36)332311721(81223)30(38)393h6151825H45161719H213H3(H3336)
methyl4(((3(2(34diethoxyphenyl)ethyl)1(4fluorophenyl)5oxo2thioxoimidazolidin4yl)acetyl)amino)benzoate
METHYL4((2(3(2(34DIETHOXYPHENYL)ETHYL)1(4FLUOROPHENYL)5OXO2SULFANYLIDENEIMIDAZOLIDIN4YL)ACETYL)AMINO)BENZOATE
METHYL4(2(3(2(34DIETHOXYPHENYL)ETHYL)1(4FLUOROPHENYL)5OXO2THIOXO13DIAZOLIDIN4YL)ACETYLAMINO)BENZOATE
MFCD03034761
ZINC000098003698
ZINC000098003699
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