Vitas-M small molecule compound
methyl 2-(acetylamino)-N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-3,3,3-trifluoroalaninate
Catalog ID
STK542291
SMILES COC(=O)C(C(F)(F)F)(Nc1sc(c(c1C#N)CC)C)NC(=O)C
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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 C14H16F3N3O3S MW 363.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16F3N3O3S/c1-5-9-7(2)24-11(10(9)6-18)20-13(12(22)23-4,14(15,16)17)19-8(3)21/h20H,5H2,1-4H3,(H,19,21)InChIKey
HXBXSQSAZNYHCQ-UHFFFAOYSA-NSynonyms
488723-90-6(S)methyl2acetamido2((3cyano4ethyl5methylthiophen2yl)amino)333trifluoropropanoate
2ACETYLAMINO2(3CYANO4ETHYL5METHYLTHIOPHEN2YLAMINO)333TRIFLUOROPROPIONICACIDMETHYLESTER
488723906
CCC1=C(SC(=C1C#N)NC(C(=O)OC)(C(F)(F)F)NC(=O)C)C
InChI=1SC14H16F3N3O3Sc1597(2)2411(10(9)618)2013(12(22)23414(1516)17)198(3)21h20H5H214H3(H1921)
methyl2(acetylamino)N(3cyano4ethyl5methylthiophen2yl)333trifluoroalaninate
METHYL2(ACETYLAMINO)N(3CYANO4ETHYL5METHYLTHIOPHEN2YL)333TRIFLUOROLALANINATE
METHYL2ACETAMIDO2((3CYANO4ETHYL5METHYLTHIOPHEN2YL)AMINO)333TRIFLUOROPROPANOATE
MFCD03291380
ZINC000002337680
ZINC000002337681
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