Vitas-M small molecule compound
ethyl N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-3,3,3-trifluoro-2-[(phenylcarbonyl)amino]alaninate
Catalog ID
STK763519
SMILES CCOC(=O)C(C(F)(F)F)(Nc1sc(c(c1C#N)CC)C)NC(=O)c1ccccc1
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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 C20H20F3N3O3S MW 439.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20F3N3O3S/c1-4-14-12(3)30-17(15(14)11-24)26-19(20(21,22)23,18(28)29-5-2)25-16(27)13-9-7-6-8-10-13/h6-10,26H,4-5H2,1-3H3,(H,25,27)InChIKey
WJVYYAIXJODQGY-UHFFFAOYSA-NSynonyms
352317-35-2352317352
CCC1=C(SC(=C1C#N)NC(C(=O)OCC)(C(F)(F)F)NC(=O)C2=CC=CC=C2)C
ETHYL2(BENZOYLAMINO)2((3CYANO4ETHYL5METHYL2THIENYL)AMINO)333TRIFLUOROPROPANOATE
ETHYL2BENZAMIDO2((3CYANO4ETHYL5METHYLTHIOPHEN2YL)AMINO)333TRIFLUOROPROPANOATE
ETHYLN(3CYANO4ETHYL5METHYLTHIOPHEN2YL)333TRIFLUORO2((PHENYLCARBONYL)AMINO)ALANINATE
InChI=1SC20H20F3N3O3Sc141412(3)3017(15(14)1124)2619(20(2122)2318(28)2952)2516(27)1397681013h61026H45H213H3(H2527)
MFCD01950168
ZINC000002050130
ZINC000002050131
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