Vitas-M small molecule compound

methyl 5-benzyl-4-methyl-2-[(trifluoroacetyl)amino]thiophene-3-carboxylate

Catalog ID
STK055990
SMILES COC(=O)c1c(NC(=O)C(F)(F)F)sc(c1C)Cc1ccccc1

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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 C16H14F3NO3S MW 357.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14F3NO3S/c1-9-11(8-10-6-4-3-5-7-10)24-13(12(9)14(21)23-2)20-15(22)16(17,18)19/h3-7H,8H2,1-2H3,(H,20,22)
InChIKey
SMYUWFHAZTZFRZ-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC)NC(=O)C(F)(F)F)CC2=CC=CC=C2
COC(=O)c1c(NC(=O)C(F)(F)F)sc(c1C)Cc1ccccc1
InChI=1SC16H14F3NO3Sc1911(8106435710)2413(12(9)14(21)232)2015(22)16(1718)19h37H8H212H3(H2022)
METHYL4METHYL5BENZYL2(222TRIFLUOROACETYLAMINO)THIOPHENE3CARBOXYLATE
METHYL5BENZYL4METHYL2((222TRIFLUOROACETYL)AMINO)THIOPHENE3CARBOXYLATE
METHYL5BENZYL4METHYL2((TRIFLUOROACETYL)AMINO)THIOPHENE3CARBOXYLATE
MFCD01120064
STK055990
ZINC000004173971
ZINC04173971
ZINC4173971

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Available files

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