Vitas-M small molecule compound

3-[4-(5,7-dimethyl-1,3-diazatricyclo[3.3.1.1~3,7~]dec-2-yl)-2,2-dimethyltetrahydro-2H-pyran-4-yl]propanenitrile

Catalog ID
STL561411
SMILES N#CCCC1(CCOC(C1)(C)C)C1N2CC3(CN1CC(C2)(C3)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 C20H33N3O MW 331.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H33N3O/c1-17(2)10-20(6-5-8-21,7-9-24-17)16-22-12-18(3)11-19(4,14-22)15-23(16)13-18/h16H,5-7,9-15H2,1-4H3
InChIKey
HQKNMQSCTTUDNB-UHFFFAOYSA-N
Synonyms
917202-39-2
17572296
3(4((1r5R7S)57dimethyl13diazaadamantan2yl)22dimethyltetrahydro2Hpyran4yl)propanenitrile
3(4(57dimethyl13diazatricyclo(3311~37~)dec2yl)22dimethyltetrahydro2Hpyran4yl)propanenitrile
3(4(57dimethyl13diazatricyclo(331137)decan2yl)22dimethyloxan4yl)propanenitrile
917202392
InChI=1SC20H33N3Oc117(2)1020(65821792417)16221218(3)1119(41422)1523(16)1318h16H57915H214H3
MFCD32649581
N#CCCC1(CCOC(C1)(C)C)C1N2C(C@)3(CN1C(C@@)(C2)(C3)C)C
ZINC000019331582
ZINC000019331586

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Available files

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