Vitas-M small molecule compound

2-butanoyl-5,5-dimethyl-3-{[2-(2-methyl-1H-indol-3-yl)ethyl]amino}cyclohex-2-en-1-one

Catalog ID
STK681170
SMILES CCCC(=O)C1=C(NCCc2c(C)[nH]c3c2cccc3)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 C23H30N2O2 MW 366.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N2O2/c1-5-8-20(26)22-19(13-23(3,4)14-21(22)27)24-12-11-16-15(2)25-18-10-7-6-9-17(16)18/h6-7,9-10,24-25H,5,8,11-14H2,1-4H3
InChIKey
CGTDXHHHSJOECM-UHFFFAOYSA-N
Synonyms
2butanoyl55dimethyl3((2(2methyl1Hindol3yl)ethyl)amino)cyclohex2en1one
2BUTANOYL55DIMETHYL3(2(2METHYL1HINDOL3YL)ETHYLAMINO)CYCLOHEX2EN1ONE
CCCC(=O)C1=C(CC(CC1=O)(C)C)NCCC2=C(NC3=CC=CC=C32)C
CCCC(=O)C1=C(NCCc2c(C)(nH)c3c2cccc3)CC(CC1=O)(C)C
CYCLOHEX2ENONE2BUTYRYL55DIMETHYL3(2(2METHYL1HINDOL3YL)ETHYLAMINO)
Registry IDs
MFCD03768344
ZINC000100139590
ZINC100139590

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Available files

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