Vitas-M small molecule compound

methyl 4-{[(4-fluorophenyl)carbonyl]amino}-2-methyl-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate

Catalog ID
STK774722
SMILES COC(=O)C1=C(C)NC(=O)C1(NC(=O)c1ccc(cc1)F)C(F)(F)F

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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 C15H12F4N2O4 MW 360.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12F4N2O4/c1-7-10(12(23)25-2)14(13(24)20-7,15(17,18)19)21-11(22)8-3-5-9(16)6-4-8/h3-6H,1-2H3,(H,20,24)(H,21,22)
InChIKey
CLBFLGWVCDRDMS-UHFFFAOYSA-N
Synonyms

CC1=C(C(C(=O)N1)(C(F)(F)F)NC(=O)C2=CC=C(C=C2)F)C(=O)OC
InChI=1SC15H12F4N2O4c1710(12(23)252)14(13(24)20715(1718)19)2111(22)8359(16)648h36H12H3(H2024)(H2122)
methyl4(((4fluorophenyl)carbonyl)amino)2methyl5oxo4(trifluoromethyl)45dihydro1Hpyrrole3carboxylate
METHYL4((4FLUOROBENZOYL)AMINO)2METHYL5OXO4(TRIFLUOROMETHYL)1HPYRROLE3CARBOXYLATE
MFCD04061209
ZINC000100152501
ZINC000100152505

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Available files

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