Vitas-M small molecule compound
ethyl 5-(diethylcarbamoyl)-4-methyl-2-{[(undecafluorocyclohexyl)carbonyl]amino}thiophene-3-carboxylate
Catalog ID
STK438268
SMILES CCOC(=O)c1c(NC(=O)C2(F)C(F)(F)C(F)(F)C(C(C2(F)F)(F)F)(F)F)sc(c1C)C(=O)N(CC)CC
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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 C20H19F11N2O4S MW 592.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19F11N2O4S/c1-5-33(6-2)12(34)10-8(4)9(13(35)37-7-3)11(38-10)32-14(36)15(21)16(22,23)18(26,27)20(30,31)19(28,29)17(15,24)25/h5-7H2,1-4H3,(H,32,36)InChIKey
DXQOCOICVULFHE-UHFFFAOYSA-NSynonyms
CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2(C(C(C(C(C2(F)F)(F)F)(F)F)(F)F)(F)F)F)C(=O)OCC)C
ethyl5(diethylcarbamoyl)4methyl2(((undecafluorocyclohexyl)carbonyl)amino)thiophene3carboxylate
ethyl5(diethylcarbamoyl)4methyl2((12233445566undecafluorocyclohexanecarbonyl)amino)thiophene3carboxylate
InChI=1SC20H19F11N2O4Sc1533(62)12(34)108(4)9(13(35)3773)11(3810)3214(36)15(21)16(2223)18(2627)20(3031)19(2829)17(1524)25h57H214H3(H3236)
MFCD03364267
ZINC000008397560
ZINC08397560
ZINC8397560
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