Vitas-M small molecule compound
2-ethyl 4-methyl 5-[(4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}butanoyl)amino]-3-methylthiophene-2,4-dicarboxylate
Catalog ID
STK340376
SMILES CCOC(=O)c1sc(c(c1C)C(=O)OC)NC(=O)CCCS(=O)(=O)c1nc(cc(n1)C(F)(F)F)c1ccc(c(c1)OC)OC
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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 C27H28F3N3O9S2 MW 659.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28F3N3O9S2/c1-6-42-25(36)22-14(2)21(24(35)41-5)23(43-22)33-20(34)8-7-11-44(37,38)26-31-16(13-19(32-26)27(28,29)30)15-9-10-17(39-3)18(12-15)40-4/h9-10,12-13H,6-8,11H2,1-5H3,(H,33,34)InChIKey
MVGRLWKTSXWSJO-UHFFFAOYSA-NSynonyms
685527-44-02ethyl4methyl5((4((4(34dimethoxyphenyl)6(trifluoromethyl)pyrimidin2yl)sulfonyl)butanoyl)amino)3methylthiophene24dicarboxylate
2Oethyl4Omethyl5(4(4(34dimethoxyphenyl)6(trifluoromethyl)pyrimidin2yl)sulfonylbutanoylamino)3methylthiophene24dicarboxylate
685527440
CCOC(=O)C1=C(C(=C(S1)NC(=O)CCCS(=O)(=O)C2=NC(=CC(=N2)C(F)(F)F)C3=CC(=C(C=C3)OC)OC)C(=O)OC)C
InChI=1SC27H28F3N3O9S2c164225(36)2214(2)21(24(35)415)23(4322)3320(34)871144(3738)263116(1319(3226)27(2829)30)1591017(393)18(1215)404h9101213H6811H215H3(H3334)
METHYL2(4((4(34DIMETHOXYPHENYL)6(TRIFLUOROMETHYL)PYRIMIDIN2YL)SULFONYL)BUTANOYLAMINO)5(ETHOXYCARBONYL)4METHYLTHIOPHENE3CARBOXYLATE
MFCD06164216
ZINC000098043170
ZINC98043170
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