Vitas-M small molecule compound
ethyl 2-[(2,2,3,3,4,4,5,5-octafluoropentanoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK467438
SMILES CCOC(=O)c1c(sc2c1CCCC2)NC(=O)C(C(C(C(F)F)(F)F)(F)F)(F)F
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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 C16H15F8NO3S MW 453.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15F8NO3S/c1-2-28-11(26)9-7-5-3-4-6-8(7)29-10(9)25-13(27)15(21,22)16(23,24)14(19,20)12(17)18/h12H,2-6H2,1H3,(H,25,27)InChIKey
YWXYJCAESDKDCC-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C(C(C(C(F)F)(F)F)(F)F)(F)F
ethyl2((22334455octafluoropentanoyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2(22334455octafluoropentanoylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC16H15F8NO3Sc122811(26)9753468(7)2910(9)2513(27)15(2122)16(2324)14(1920)12(17)18h12H26H21H3(H2527)
MFCD00340009
ZINC000003158348
ZINC3158348
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