Vitas-M small molecule compound

methyl 4-ethyl-2-{[1,1,1,3,3,3-hexafluoro-2-(propanoylamino)propan-2-yl]amino}-5-methylthiophene-3-carboxylate

Catalog ID
STK537058
SMILES CCC(=O)NC(C(F)(F)F)(C(F)(F)F)Nc1sc(c(c1C(=O)OC)CC)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 C15H18F6N2O3S MW 420.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18F6N2O3S/c1-5-8-7(3)27-11(10(8)12(25)26-4)23-13(14(16,17)18,15(19,20)21)22-9(24)6-2/h23H,5-6H2,1-4H3,(H,22,24)
InChIKey
NKAITGVVFLFMHF-UHFFFAOYSA-N
Synonyms

CCC1=C(SC(=C1C(=O)OC)NC(C(F)(F)F)(C(F)(F)F)NC(=O)CC)C
InChI=1SC15H18F6N2O3Sc1587(3)2711(10(8)12(25)264)2313(14(1617)1815(1920)21)229(24)62h23H56H214H3(H2224)
methyl4ethyl2((111333hexafluoro2(propanoylamino)propan2yl)amino)5methylthiophene3carboxylate
methyl4ethyl2((111333hexafluoro2propionamidopropan2yl)amino)5methylthiophene3carboxylate
MFCD02647444
ZINC000002303408
ZINC02303408
ZINC2303408

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.