Vitas-M small molecule compound
2-butanoyl-5,5-dimethyl-3-(pyridin-4-ylamino)cyclohex-2-en-1-one
Catalog ID
STL326632
SMILES CCCC(=O)C1=C(Nc2ccncc2)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 C17H22N2O2 MW 286.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O2/c1-4-5-14(20)16-13(10-17(2,3)11-15(16)21)19-12-6-8-18-9-7-12/h6-9H,4-5,10-11H2,1-3H3,(H,18,19)InChIKey
MHEHJQHGLABKRF-UHFFFAOYSA-NSynonyms
2BUTANOYL55DIMETHYL3(4PYRIDYLAMINO)CYCLOHEX2EN1ONE
2butanoyl55dimethyl3(pyridin4ylamino)cyclohex2en1one
2BUTYRYL55DIMETHYL3(PYRIDIN4YLAMINO)CYCLOHEX2ENONE
CCCC(=O)C1=C(CC(CC1=O)(C)C)NC2=CC=NC=C2
InChI=1SC17H22N2O2c14514(20)1613(1017(23)1115(16)21)191268189712h69H451011H213H3(H1819)
MFCD00513004
ZINC000000287258
ZINC00287258
ZINC287258
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