Vitas-M small molecule compound
1-benzyl-8-[(2E)-2-(2-chlorobenzylidene)hydrazinyl]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK697833
SMILES Clc1ccccc1/C=N/Nc1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1ccccc1
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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 C21H19ClN6O2 MW 422.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN6O2/c1-26-17-18(24-20(26)25-23-12-15-10-6-7-11-16(15)22)27(2)21(30)28(19(17)29)13-14-8-4-3-5-9-14/h3-12H,13H2,1-2H3,(H,24,25)/b23-12+InChIKey
DBVYPMMWGSBYRR-FSJBWODESA-NSynonyms
(E)1benzyl8(2(2chlorobenzylidene)hydrazinyl)37dimethyl1Hpurine26(3H7H)dione
1benzyl8((2E)2((2chlorophenyl)methylidene)hydrazinyl)37dimethylpurine26dione
1benzyl8((2E)2(2chlorobenzylidene)hydrazinyl)37dimethyl37dihydro1Hpurine26dione
Clc1ccccc1C=NNc1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1ccccc1
CN1C2=C(N=C1NN=CC3=CC=CC=C3Cl)N(C(=O)N(C2=O)CC4=CC=CC=C4)C
InChI=1SC21H19ClN6O2c1261718(2420(26)2523121510671116(15)22)27(2)21(30)28(19(17)29)13148435914h312H13H212H3(H2425)b2312+
MFCD02994865
ZINC000008996189
ZINC102629609
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