Vitas-M small molecule compound
5-amino-3-(4-methoxyphenyl)-7-oxo-4-propyl-6-azabicyclo[3.2.1]octane-1,2,2-tricarbonitrile
Catalog ID
STK764926
SMILES CCCC1C(c2ccc(cc2)OC)C(C#N)(C#N)C2(CC1(N)NC2=O)C#N
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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 C20H21N5O2 MW 363.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O2/c1-3-4-15-16(13-5-7-14(27-2)8-6-13)19(11-22,12-23)18(10-21)9-20(15,24)25-17(18)26/h5-8,15-16H,3-4,9,24H2,1-2H3,(H,25,26)InChIKey
JQQIKQWMRUJFLZ-UHFFFAOYSA-NSynonyms
439288-56-9439288569
5amino3(4methoxyphenyl)7oxo4propyl6azabicyclo(321)octane122tricarbonitrile
6AZABICYCLO(321)OCTANE122TRICARBONITRILE5AMINO3(4METHOXYPHENYL)7OXO4PROPYL
CCCC1C(C(C2(CC1(NC2=O)N)C#N)(C#N)C#N)C3=CC=C(C=C3)OC
InChI=1SC20H21N5O2c1341516(135714(272)8613)19(11221223)18(1021)920(1524)2517(18)26h581516H34924H212H3(H2526)
MFCD02933353
ZINC000169364263
ZINC000169364266
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