Vitas-M small molecule compound
2-butanoyl-3-{[2-(2-methyl-1H-indol-3-yl)ethyl]amino}-5-phenylcyclohex-2-en-1-one
Catalog ID
STK682318
SMILES CCCC(=O)C1=C(NCCc2c(C)[nH]c3c2cccc3)CC(CC1=O)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 C27H30N2O2 MW 414.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2O2/c1-3-9-25(30)27-24(16-20(17-26(27)31)19-10-5-4-6-11-19)28-15-14-21-18(2)29-23-13-8-7-12-22(21)23/h4-8,10-13,20,28-29H,3,9,14-17H2,1-2H3InChIKey
PIMXPLHXYJVPML-UHFFFAOYSA-NSynonyms
2butanoyl3((2(2methyl1Hindol3yl)ethyl)amino)5phenylcyclohex2en1one
2BUTANOYL3(2(2METHYL1HINDOL3YL)ETHYLAMINO)5PHENYLCYCLOHEX2EN1ONE
2BUTYRYL3((2(2METHYL1HINDOL3YL)ETHYL)AMINO)5PHENYLCYCLOHEX2EN1ONE
CCCC(=O)C1=C(CC(CC1=O)C2=CC=CC=C2)NCCC3=C(NC4=CC=CC=C43)C
CCCC(=O)C1=C(NCCc2c(C)(nH)c3c2cccc3)CC(CC1=O)c1ccccc1
InChI=1SC27H30N2O2c13925(30)2724(1620(1726(27)31)19105461119)2815142118(2)292313871222(21)23h481013202829H391417H212H3
MFCD03855299
ZINC000001080649
ZINC000001080650
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