Vitas-M small molecule compound
5-hydroxy-8-methyl-7-oxo-3-phenyl-6-azabicyclo[3.2.1]octane-1,2,2-tricarbonitrile
Catalog ID
STL000586
SMILES N#CC1(C#N)C(CC2(C(C1(C#N)C(=O)N2)C)O)c1ccccc1
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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 C17H14N4O2 MW 306.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N4O2/c1-11-16(10-20)14(22)21-17(11,23)7-13(15(16,8-18)9-19)12-5-3-2-4-6-12/h2-6,11,13,23H,7H2,1H3,(H,21,22)InChIKey
CDQRUXMHJJPZRU-UHFFFAOYSA-NSynonyms
434329-17-61HYDROXY8METHYL6OXO3PHENYL7AZABICYCLO(321)OCTANE445TRICARBONITRILE
434329176
5hydroxy8methyl7oxo3phenyl6azabicyclo(321)octane122tricarbonitrile
CC1C2(CC(C(C1(C(=O)N2)C#N)(C#N)C#N)C3=CC=CC=C3)O
InChI=1SC17H14N4O2c11116(1020)14(22)2117(1123)713(15(16818)919)125324612h26111323H7H21H3(H2122)
MFCD01959574
ZINC000135840244
ZINC000239284843
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