Vitas-M small molecule compound

5,5-dimethyl-2-[1-({2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl}amino)pentylidene]cyclohexane-1,3-dione

Catalog ID
STK681204
SMILES CCCCC(=C1C(=O)CC(CC1=O)(C)C)NCCc1c(C)[nH]c2c1cc(cc2)OC(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 C25H31F3N2O3 MW 464.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31F3N2O3/c1-5-6-7-20(23-21(31)13-24(3,4)14-22(23)32)29-11-10-17-15(2)30-19-9-8-16(12-18(17)19)33-25(26,27)28/h8-9,12,29-30H,5-7,10-11,13-14H2,1-4H3
InChIKey
DIVBZWMQJOULRC-UHFFFAOYSA-N
Synonyms
55dimethyl2(1((2(2methyl5(trifluoromethoxy)1Hindol3yl)ethyl)amino)pentylidene)cyclohexane13dione
55DIMETHYL2(1(2(2METHYL5(TRIFLUOROMETHOXY)1HINDOL3YL)ETHYLAMINO)PENTYLIDENE)CYCLOHEXANE13DIONE
CCCCC(=C1C(=O)CC(CC1=O)(C)C)NCCc1c(C)(nH)c2c1cc(cc2)OC(F)(F)F
CCCCC(=C1C(=O)CC(CC1=O)(C)C)NCCC2=C(NC3=C2C=C(C=C3)OC(F)(F)F)C
Registry IDs
MFCD03768652
ZINC000100140077
ZINC100140077

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Available files

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