Vitas-M small molecule compound

methyl 4,5-dioxo-3-(phenylcarbonyl)-1-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-pyrrole-2-carboxylate

Catalog ID
STK758799
SMILES COC(=O)C1=C(C(=O)C(=O)N1c1cccc(c1)C(F)(F)F)C(=O)c1ccccc1

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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 C20H12F3NO5 MW 403.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12F3NO5/c1-29-19(28)15-14(16(25)11-6-3-2-4-7-11)17(26)18(27)24(15)13-9-5-8-12(10-13)20(21,22)23/h2-10H,1H3
InChIKey
HDAYFSSKBOCRBE-UHFFFAOYSA-N
Synonyms

COC(=O)C1=C(C(=O)C(=O)N1C2=CC=CC(=C2)C(F)(F)F)C(=O)C3=CC=CC=C3
InChI=1SC20H12F3NO5c12919(28)1514(16(25)116324711)17(26)18(27)24(15)1395812(1013)20(2122)23h210H1H3
METHYL3BENZOYL45DIOXO1(3(TRIFLUOROMETHYL)PHENYL)PYRROLE2CARBOXYLATE
methyl45dioxo3(phenylcarbonyl)1(3(trifluoromethyl)phenyl)45dihydro1Hpyrrole2carboxylate
MFCD01460290
ZINC000002500864
ZINC02500864
ZINC2500864

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Available files

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