Vitas-M small molecule compound
(5s,7s)-2-(4-ethylphenyl)-5-methyl-7-propyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Catalog ID
STL513973
SMILES CCC[C@]12CN3C[C@@](C2=O)(CN(C1)C3c1ccc(cc1)CC)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/c1-4-10-20-13-21-11-19(3,18(20)23)12-22(14-20)17(21)16-8-6-15(5-2)7-9-16/h6-9,17H,4-5,10-14H2,1-3H3/t17?,19-,20+InChIKey
YFANOIYJIMRHQM-CTXDPNEZSA-NSynonyms
(1S5R7S)2(4ethylphenyl)5methyl7propyl13diazaadamantan6one
(5s7s)2(4ethylphenyl)5methyl7propyl13diazatricyclo(3311~37~)decan6one
CCC(C@)12CN3C(C@@)(C2=O)(CN(C1)C3c1ccc(cc1)CC)C
InChI=1SC20H28N2Oc14102013211119(318(20)23)1222(1420)17(21)168615(52)7916h6917H451014H213H3t17?1920+
MFCD06763956
ZINC000019323321
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