Vitas-M small molecule compound
1-benzyl-8-[(2E)-2-(2,4-dichlorobenzylidene)hydrazinyl]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK697831
SMILES Clc1ccc(c(c1)Cl)/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 C21H18Cl2N6O2 MW 457.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18Cl2N6O2/c1-27-17-18(25-20(27)26-24-11-14-8-9-15(22)10-16(14)23)28(2)21(31)29(19(17)30)12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H,25,26)/b24-11+InChIKey
RFVSXTWXVKDLLD-BHGWPJFGSA-NSynonyms
(E)1benzyl8(2(24dichlorobenzylidene)hydrazinyl)37dimethyl1Hpurine26(3H7H)dione
1benzyl8((2E)2((24dichlorophenyl)methylidene)hydrazinyl)37dimethylpurine26dione
1benzyl8((2E)2(24dichlorobenzylidene)hydrazinyl)37dimethyl37dihydro1Hpurine26dione
Clc1ccc(c(c1)Cl)C=NNc1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1ccccc1
CN1C2=C(N=C1NN=CC3=C(C=C(C=C3)Cl)Cl)N(C(=O)N(C2=O)CC4=CC=CC=C4)C
InChI=1SC21H18Cl2N6O2c1271718(2520(27)262411148915(22)1016(14)23)28(2)21(31)29(19(17)30)12136435713h311H12H212H3(H2526)b2411+
MFCD02988617
ZINC000008743541
ZINC33733180
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