Vitas-M small molecule compound

methyl 4-(acetylamino)-1-butyl-2-methyl-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate

Catalog ID
STK792176
SMILES CCCCN1C(=C(C(C1=O)(NC(=O)C)C(F)(F)F)C(=O)OC)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 C14H19F3N2O4 MW 336.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H19F3N2O4/c1-5-6-7-19-8(2)10(11(21)23-4)13(12(19)22,14(15,16)17)18-9(3)20/h5-7H2,1-4H3,(H,18,20)
InChIKey
FJDTWYYPPYPQQN-UHFFFAOYSA-N
Synonyms

1HPYRROLE3CARBOXYLICACID4(ACETYLAMINO)1BUTYL45DIHYDRO2METHYL5OXO4(TRIFLUOROMETHYL)METHYLESTER
CCCCN1C(=C(C(C1=O)(C(F)(F)F)NC(=O)C)C(=O)OC)C
InChI=1SC14H19F3N2O4c1567198(2)10(11(21)234)13(12(19)2214(1516)17)189(3)20h57H214H3(H1820)
methyl4(acetylamino)1butyl2methyl5oxo4(trifluoromethyl)45dihydro1Hpyrrole3carboxylate
methyl4acetamido1butyl2methyl5oxo4(trifluoromethyl)pyrrole3carboxylate
MFCD08098259
ZINC000012419934
ZINC000012419937

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Available files

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