Vitas-M small molecule compound

methyl 2-{[2-(acetylamino)-1,1,1,3,3,3-hexafluoropropan-2-yl]amino}-4-ethyl-5-methylthiophene-3-carboxylate

Catalog ID
STK537115
SMILES COC(=O)c1c(sc(c1CC)C)NC(C(F)(F)F)(C(F)(F)F)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 C14H16F6N2O3S MW 406.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16F6N2O3S/c1-5-8-6(2)26-10(9(8)11(24)25-4)22-12(13(15,16)17,14(18,19)20)21-7(3)23/h22H,5H2,1-4H3,(H,21,23)
InChIKey
BVGHQQDDXNSHPH-UHFFFAOYSA-N
Synonyms

CCC1=C(SC(=C1C(=O)OC)NC(C(F)(F)F)(C(F)(F)F)NC(=O)C)C
InChI=1SC14H16F6N2O3Sc1586(2)2610(9(8)11(24)254)2212(13(1516)1714(1819)20)217(3)23h22H5H214H3(H2123)
methyl2((2(acetylamino)111333hexafluoropropan2yl)amino)4ethyl5methylthiophene3carboxylate
methyl2((2acetamido111333hexafluoropropan2yl)amino)4ethyl5methylthiophene3carboxylate
MFCD02647495
ZINC000002355686
ZINC02355686
ZINC2355686

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Available files

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