Vitas-M small molecule compound

ethyl 1-cyclohexyl-2-methyl-5-{[4-(trifluoromethyl)benzyl]oxy}-1H-indole-3-carboxylate

Catalog ID
STL365458
SMILES CCOC(=O)c1c(C)n(c2c1cc(OCc1ccc(cc1)C(F)(F)F)cc2)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 C26H28F3NO3 MW 459.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28F3NO3/c1-3-32-25(31)24-17(2)30(20-7-5-4-6-8-20)23-14-13-21(15-22(23)24)33-16-18-9-11-19(12-10-18)26(27,28)29/h9-15,20H,3-8,16H2,1-2H3
InChIKey
WZBVLOXURKUSOX-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC3=CC=C(C=C3)C(F)(F)F)C4CCCCC4)C
ethyl1cyclohexyl2methyl5((4(trifluoromethyl)benzyl)oxy)1Hindole3carboxylate
ethyl1cyclohexyl2methyl5((4(trifluoromethyl)phenyl)methoxy)indole3carboxylate
InChI=1SC26H28F3NO3c133225(31)2417(2)30(207546820)23141321(1522(23)24)33161891119(121018)26(2728)29h91520H3816H212H3
MFCD03206578
ZINC000015019015
ZINC15019015

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Available files

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