Vitas-M small molecule compound

ethyl 4-[6,6-dimethyl-3-{[(4-methylphenyl)carbonyl]amino}-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-1-yl]benzoate

Catalog ID
STK682814
SMILES CCOC(=O)c1ccc(cc1)N1C2=C(C(C1=O)(NC(=O)c1ccc(cc1)C)C(F)(F)F)C(=O)CC(C2)(C)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 C28H27F3N2O5 MW 528.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27F3N2O5/c1-5-38-24(36)18-10-12-19(13-11-18)33-20-14-26(3,4)15-21(34)22(20)27(25(33)37,28(29,30)31)32-23(35)17-8-6-16(2)7-9-17/h6-13H,5,14-15H2,1-4H3,(H,32,35)
InChIKey
BGKJSBWTEMPVKA-UHFFFAOYSA-N
Synonyms
CCOC(=O)C1=CC=C(C=C1)N2C3=C(C(=O)CC(C3)(C)C)C(C2=O)(C(F)(F)F)NC(=O)C4=CC=C(C=C4)C
ethyl4(66dimethyl3(((4methylphenyl)carbonyl)amino)24dioxo3(trifluoromethyl)234567hexahydro1Hindol1yl)benzoate
ETHYL4(66DIMETHYL3((4METHYLBENZOYL)AMINO)24DIOXO3(TRIFLUOROMETHYL)57DIHYDROINDOL1YL)BENZOATE
Registry IDs
MFCD04060882
ZINC000003629228
ZINC000003629229

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Available files

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