Vitas-M small molecule compound
(5s,7s)-2-(4-ethoxy-3-methoxyphenyl)-5,7-dipropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Catalog ID
STL516526
SMILES CCC[C@]12CN3C[C@@](C2=O)(CN(C1)C3c1ccc(c(c1)OC)OCC)CCC
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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 C23H34N2O3 MW 386.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H34N2O3/c1-5-10-22-13-24-15-23(11-6-2,21(22)26)16-25(14-22)20(24)17-8-9-18(28-7-3)19(12-17)27-4/h8-9,12,20H,5-7,10-11,13-16H2,1-4H3/t20?,22-,23+InChIKey
ZWUYTQQSDZFCQR-BRTIRZTQSA-NSynonyms
(1r5R7S)2(4ethoxy3methoxyphenyl)57dipropyl13diazaadamantan6one
(5s7s)2(4ethoxy3methoxyphenyl)57dipropyl13diazatricyclo(3311~37~)decan6one
CCC(C@)12CN3C(C@@)(C2=O)(CN(C1)C3c1ccc(c(c1)OC)OCC)CCC
InChI=1SC23H34N2O3c15102213241523(116221(22)26)1625(1422)20(24)178918(2873)19(1217)274h891220H5710111316H214H3t20?2223+
MFCD06766774
ZINC000019323600
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