Vitas-M small molecule compound
(3S)-2-(3,4-difluorophenyl)-3-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)cyclopropane-1,1-dicarbonitrile
Catalog ID
STK547738
SMILES N#CC1(C#N)C([C@@H]1C(=O)C12CC3CC(C2)CC(C1)C3)c1ccc(c(c1)F)F
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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 C22H20F2N2O MW 366.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20F2N2O/c23-16-2-1-15(6-17(16)24)18-19(22(18,10-25)11-26)20(27)21-7-12-3-13(8-21)5-14(4-12)9-21/h1-2,6,12-14,18-19H,3-5,7-9H2/t12?,13?,14?,18?,19-,21?/m1/s1InChIKey
LLYIYFWZFAYMSZ-WMONUWQVSA-NSynonyms
494794-10-4(2S)2((3S5S7S)adamantane1carbonyl)3(34difluorophenyl)cyclopropane11dicarbonitrile
(2S)2(adamantane1carbonyl)3(34difluorophenyl)cyclopropane11dicarbonitrile
(3S)2(34difluorophenyl)3(tricyclo(3311~37~)dec1ylcarbonyl)cyclopropane11dicarbonitrile
494794104
C1C2CC3CC1CC(C2)(C3)C(=O)C4C(C4(C#N)C#N)C5=CC(=C(C=C5)F)F
InChI=1SC22H20F2N2Oc23162115(617(16)24)1819(22(181025)1126)20(27)21712313(821)514(412)921h12612141819H3579H2t12?13?14?18?1921?m1s1
MFCD18242366
N#CC1(C#N)C((C@@H)1C(=O)C12CC3CC(C2)CC(C1)C3)c1ccc(c(c1)F)F
ZINC000004652936
ZINC000004652937
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