Vitas-M small molecule compound
2-(5-bromo-2-methoxyphenyl)-5-ethyl-7-methyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Catalog ID
STK721116
SMILES COc1ccc(cc1C1N2CC3(CN1CC(C2)(C3=O)CC)C)Br
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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 C18H23BrN2O2 MW 379.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23BrN2O2/c1-4-18-10-20-8-17(2,16(18)22)9-21(11-18)15(20)13-7-12(19)5-6-14(13)23-3/h5-7,15H,4,8-11H2,1-3H3InChIKey
GGXNHZAVIPPUEG-UHFFFAOYSA-NSynonyms
(1S5S7R)2(5bromo2methoxyphenyl)5ethyl7methyl13diazaadamantan6one
2(5bromo2methoxyphenyl)5ethyl7methyl13diazatricyclo(3311~37~)decan6one
CCC12CN3CC(C1=O)(CN(C2)C3C4=C(C=CC(=C4)Br)OC)C
COc1ccc(cc1C1N2C(C@@)3(CN1C(C@)(C2)(C3=O)CC)C)Br
InChI=1SC18H23BrN2O2c14181020817(216(18)22)921(1118)15(20)13712(19)5614(13)233h5715H4811H213H3
MFCD09698459
ZINC000019327320
ZINC19327320
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