Vitas-M small molecule compound
2-butanoyl-5,5-dimethyl-3-({2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl}amino)cyclohex-2-en-1-one
Catalog ID
STK680922
SMILES CCCC(=O)C1=C(NCCc2c(C)[nH]c3c2cc(cc3)OC(F)(F)F)CC(CC1=O)(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 C24H29F3N2O3 MW 450.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29F3N2O3/c1-5-6-20(30)22-19(12-23(3,4)13-21(22)31)28-10-9-16-14(2)29-18-8-7-15(11-17(16)18)32-24(25,26)27/h7-8,11,28-29H,5-6,9-10,12-13H2,1-4H3InChIKey
OKXIMDYASLYKHQ-UHFFFAOYSA-NSynonyms
2butanoyl55dimethyl3((2(2methyl5(trifluoromethoxy)1Hindol3yl)ethyl)amino)cyclohex2en1one
2BUTANOYL55DIMETHYL3(2(2METHYL5(TRIFLUOROMETHOXY)1HINDOL3YL)ETHYLAMINO)CYCLOHEX2EN1ONE
CCCC(=O)C1=C(CC(CC1=O)(C)C)NCCC2=C(NC3=C2C=C(C=C3)OC(F)(F)F)C
CCCC(=O)C1=C(NCCc2c(C)(nH)c3c2cc(cc3)OC(F)(F)F)CC(CC1=O)(C)C
InChI=1SC24H29F3N2O3c15620(30)2219(1223(34)1321(22)31)281091614(2)29188715(1117(16)18)3224(2526)27h78112829H569101213H214H3
MFCD03767737
ZINC000100137744
ZINC100137744
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