Vitas-M small molecule compound
8-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-7-(4-chlorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK556320
SMILES Clc1ccc(cc1)Cn1c(N/N=C/c2ccc(cc2)Br)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 C21H18BrClN6O2 MW 501.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrClN6O2/c1-27-18-17(19(30)28(2)21(27)31)29(12-14-5-9-16(23)10-6-14)20(25-18)26-24-11-13-3-7-15(22)8-4-13/h3-11H,12H2,1-2H3,(H,25,26)/b24-11+InChIKey
ICJFUBUXMRJXQX-BHGWPJFGSA-NSynonyms
536719-18-3(E)8(2(4bromobenzylidene)hydrazinyl)7(4chlorobenzyl)13dimethyl1Hpurine26(3H7H)dione
536719183
8((2E)2((4bromophenyl)methylidene)hydrazinyl)7((4chlorophenyl)methyl)13dimethylpurine26dione
8((2E)2(4bromobenzylidene)hydrazinyl)7(4chlorobenzyl)13dimethyl37dihydro1Hpurine26dione
Clc1ccc(cc1)Cn1c(NN=Cc2ccc(cc2)Br)nc2c1c(=O)n(c(=O)n2C)C
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NN=CC3=CC=C(C=C3)Br)CC4=CC=C(C=C4)Cl
InChI=1SC21H18BrClN6O2c1271817(19(30)28(2)21(27)31)29(12145916(23)10614)20(2518)262411133715(22)8413h311H12H212H3(H2526)b2411+
MFCD04017197
ZINC000009459718
ZINC33776354
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