Vitas-M small molecule compound
ethyl 4-carbamoyl-5-[(4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}butanoyl)amino]-3-methylthiophene-2-carboxylate
Catalog ID
STK340374
SMILES CCOC(=O)c1sc(c(c1C)C(=O)N)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 C26H27F3N4O8S2 MW 644.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27F3N4O8S2/c1-5-41-24(36)21-13(2)20(22(30)35)23(42-21)33-19(34)7-6-10-43(37,38)25-31-15(12-18(32-25)26(27,28)29)14-8-9-16(39-3)17(11-14)40-4/h8-9,11-12H,5-7,10H2,1-4H3,(H2,30,35)(H,33,34)InChIKey
XNZFOOAZBTVODF-UHFFFAOYSA-NSynonyms
685527-42-8685527428
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)N)C
ethyl4carbamoyl5((4((4(34dimethoxyphenyl)6(trifluoromethyl)pyrimidin2yl)sulfonyl)butanoyl)amino)3methylthiophene2carboxylate
ethyl4carbamoyl5(4(4(34dimethoxyphenyl)6(trifluoromethyl)pyrimidin2yl)sulfonylbutanoylamino)3methylthiophene2carboxylate
ETHYL5(4((4(34DIMETHOXYPHENYL)6(TRIFLUOROMETHYL)PYRIMIDIN2YL)SULFONYL)BUTANOYLAMINO)4CARBAMOYL3METHYLTHIOPHENE2CARBOXYLATE
InChI=1SC26H27F3N4O8S2c154124(36)2113(2)20(22(30)35)23(4221)3319(34)761043(3738)253115(1218(3225)26(2728)29)148916(393)17(1114)404h891112H5710H214H3(H23035)(H3334)
MFCD06164214
ZINC000004176735
ZINC4176735
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.