Vitas-M small molecule compound
(5Z)-1,4-dimethyl-2,6-dioxo-5-[(1,3,5-triazatricyclo[3.3.1.1~3,7~]dec-7-ylamino)methylidene]-1,2,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK957360
SMILES N#CC1=C(C)/C(=C/NC23CN4CN(C3)CN(C2)C4)/C(=O)N(C1=O)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 C16H20N6O2 MW 328.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N6O2/c1-11-12(3-17)14(23)19(2)15(24)13(11)4-18-16-5-20-8-21(6-16)10-22(7-16)9-20/h4,18H,5-10H2,1-2H3/b13-4-InChIKey
HNEBBHCGYKRJAP-PQMHYQBVSA-NSynonyms
354546-50-2(5Z)14dimethyl26dioxo5((135triazatricyclo(3311~37~)dec7ylamino)methylidene)1256tetrahydropyridine3carbonitrile
354546502
CC1=C(C(=O)N(C(=O)C1=CNC23CN4CN(C2)CN(C3)C4)C)C#N
InChI=1SC16H20N6O2c11112(317)14(23)19(2)15(24)13(11)41816520821(616)1022(716)920h418H510H212H3b134
MFCD01178666
N#CC1=C(C)C(=CNC23CN4CN(C3)CN(C2)C4)C(=O)N(C1=O)C
ZINC000019329365
ZINC19329365
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