Vitas-M small molecule compound
7-ethyl-8-[(2E)-2-(4-fluorobenzylidene)hydrazinyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK539279
SMILES CCn1c(N/N=C/c2ccc(cc2)F)nc2c1c(=O)n(c(=O)n2C)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 C16H17FN6O2 MW 344.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17FN6O2/c1-4-23-12-13(21(2)16(25)22(3)14(12)24)19-15(23)20-18-9-10-5-7-11(17)8-6-10/h5-9H,4H2,1-3H3,(H,19,20)/b18-9+InChIKey
BJBLDBHDFNEXPU-GIJQJNRQSA-NSynonyms
(E)7ethyl8(2(4fluorobenzylidene)hydrazinyl)13dimethyl1Hpurine26(3H7H)dione
7ethyl8((2E)2((4fluorophenyl)methylidene)hydrazinyl)13dimethylpurine26dione
7ethyl8((2E)2(4fluorobenzylidene)hydrazinyl)13dimethyl37dihydro1Hpurine26dione
CCn1c(NN=Cc2ccc(cc2)F)nc2c1c(=O)n(c(=O)n2C)C
CCN1C2=C(N=C1NN=CC3=CC=C(C=C3)F)N(C(=O)N(C2=O)C)C
InChI=1SC16H17FN6O2c14231213(21(2)16(25)22(3)14(12)24)1915(23)20189105711(17)8610h59H4H213H3(H1920)b189+
MFCD02240853
ZINC000004811888
ZINC71782642
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