Vitas-M small molecule compound
5-butyl-7-methyl-2-(2-methylphenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Catalog ID
STL522392
SMILES CCCCC12CN3CC(C2=O)(CN(C1)C3c1ccccc1C)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 C20H28N2O MW 312.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N2O/c1-4-5-10-20-13-21-11-19(3,18(20)23)12-22(14-20)17(21)16-9-7-6-8-15(16)2/h6-9,17H,4-5,10-14H2,1-3H3InChIKey
KOKQLEKFQCBARF-UHFFFAOYSA-NSynonyms
956046-85-8(5s7s)5butyl7methyl2(otolyl)13diazaadamantan6one
1758007
5butyl7methyl2(2methylphenyl)13diazatricyclo(3311^(37))decan6one
5butyl7methyl2(2methylphenyl)13diazatricyclo(3311~37~)decan6one
956046858
CCCC(C@)12CN3C(C@@)(C2=O)(CN(C1)C3c1ccccc1C)C
InChI=1SC20H28N2Oc145102013211119(318(20)23)1222(1420)17(21)16976815(16)2h6917H451014H213H3
MFCD06166307
ZINC000019320102
ZINC19320102
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