Vitas-M small molecule compound
(8E)-7-(2-chlorobenzyl)-8-(cyclopentylidenehydrazinylidene)-1,3-dimethyl-3,7,8,9-tetrahydro-1H-purine-2,6-dione
Catalog ID
STL056081
SMILES Clc1ccccc1Cn1/c(=N/N=C2CCCC2)/[nH]c2c1c(=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 C19H21ClN6O2 MW 400.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21ClN6O2/c1-24-16-15(17(27)25(2)19(24)28)26(11-12-7-3-6-10-14(12)20)18(21-16)23-22-13-8-4-5-9-13/h3,6-7,10H,4-5,8-9,11H2,1-2H3,(H,21,23)InChIKey
RIFXVHQLFHNNMZ-UHFFFAOYSA-NSynonyms
713129-21-6(8E)7(2chlorobenzyl)8(cyclopentylidenehydrazinylidene)13dimethyl3789tetrahydro1Hpurine26dione
7((2CHLOROPHENYL)METHYL)8(2CYCLOPENTYLIDENEHYDRAZINYL)13DIMETHYLPURINE26DIONE
7(2CHLOROBENZYL)8(2CYCLOPENTYLIDENEHYDRAZINYL)13DIMETHYL37DIHYDRO1HPURINE26DIONE
713129216
Clc1ccccc1Cn1c(=NN=C2CCCC2)(nH)c2c1c(=O)n(c(=O)n2C)C
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NN=C3CCCC3)CC4=CC=CC=C4Cl
InChI=1SC19H21ClN6O2c1241615(17(27)25(2)19(24)28)26(11127361014(12)20)18(2116)232213845913h36710H458911H212H3(H2123)
MFCD05727305
ZINC000005025298
ZINC05025298
ZINC5025298
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