Vitas-M small molecule compound

6,6-dimethyl-3-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1-(2-phenylethyl)-3-(trifluoromethyl)-3,5,6,7-tetrahydro-1H-indole-2,4-dione

Catalog ID
STK773259
SMILES O=C1CC(C)(C)CC2=C1C(C(=O)N2CCc1ccccc1)(c1c(C)[nH]n(c1=O)c1ccccc1)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 C29H28F3N3O3 MW 523.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28F3N3O3/c1-18-23(25(37)35(33-18)20-12-8-5-9-13-20)28(29(30,31)32)24-21(16-27(2,3)17-22(24)36)34(26(28)38)15-14-19-10-6-4-7-11-19/h4-13,33H,14-17H2,1-3H3
InChIKey
VNWRZIFECDBPJV-UHFFFAOYSA-N
Synonyms

66dimethyl3(5methyl3oxo2phenyl1Hpyrazol4yl)1(2phenylethyl)3(trifluoromethyl)57dihydroindole24dione
66DIMETHYL3(5METHYL3OXO2PHENYL1HPYRAZOL4YL)1PHENETHYL3(TRIFLUOROMETHYL)57DIHYDROINDOLE24DIONE
66dimethyl3(5methyl3oxo2phenyl23dihydro1Hpyrazol4yl)1(2phenylethyl)3(trifluoromethyl)3567tetrahydro1Hindole24dione
CC1=C(C(=O)N(N1)C2=CC=CC=C2)C3(C4=C(CC(CC4=O)(C)C)N(C3=O)CCC5=CC=CC=C5)C(F)(F)F
InChI=1SC29H28F3N3O3c11823(25(37)35(3318)20128591320)28(29(3031)32)2421(1627(23)1722(24)36)34(26(28)38)151419106471119h41333H1417H213H3
MFCD03821523
O=C1CC(C)(C)CC2=C1C(C(=O)N2CCc1ccccc1)(c1c(C)(nH)n(c1=O)c1ccccc1)C(F)(F)F
ZINC000003626888
ZINC000003626890

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Available files

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