Vitas-M small molecule compound
methyl 4-[({3-[2-(3,4-diethoxyphenyl)ethyl]-5-oxo-2-thioxo-1-[3-(trifluoromethyl)phenyl]imidazolidin-4-yl}acetyl)amino]benzoate
Catalog ID
STK678357
SMILES CCOc1cc(CCN2C(=S)N(C(=O)C2CC(=O)Nc2ccc(cc2)C(=O)OC)c2cccc(c2)C(F)(F)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 C32H32F3N3O6S MW 643.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32F3N3O6S/c1-4-43-26-14-9-20(17-27(26)44-5-2)15-16-37-25(19-28(39)36-23-12-10-21(11-13-23)30(41)42-3)29(40)38(31(37)45)24-8-6-7-22(18-24)32(33,34)35/h6-14,17-18,25H,4-5,15-16,19H2,1-3H3,(H,36,39)InChIKey
HEOOGKJVCKZJRC-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)CCN2C(C(=O)N(C2=S)C3=CC=CC(=C3)C(F)(F)F)CC(=O)NC4=CC=C(C=C4)C(=O)OC)OCC
InChI=1SC32H32F3N3O6Sc14432614920(1727(26)4452)15163725(1928(39)3623121021(111323)30(41)423)29(40)38(31(37)45)2486722(1824)32(3334)35h614171825H45151619H213H3(H3639)
methyl4(((3(2(34diethoxyphenyl)ethyl)5oxo2thioxo1(3(trifluoromethyl)phenyl)imidazolidin4yl)acetyl)amino)benzoate
METHYL4((2(3(2(34DIETHOXYPHENYL)ETHYL)5OXO2SULFANYLIDENE1(3(TRIFLUOROMETHYL)PHENYL)IMIDAZOLIDIN4YL)ACETYL)AMINO)BENZOATE
MFCD03034611
ZINC000049766512
ZINC000049766514
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