Vitas-M small molecule compound
(8E)-7-(2-chlorobenzyl)-8-(cycloheptylidenehydrazinylidene)-1,3-dimethyl-3,7,8,9-tetrahydro-1H-purine-2,6-dione
Catalog ID
STL052017
SMILES Clc1ccccc1Cn1/c(=N/N=C2CCCCCC2)/[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 C21H25ClN6O2 MW 428.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25ClN6O2/c1-26-18-17(19(29)27(2)21(26)30)28(13-14-9-7-8-12-16(14)22)20(23-18)25-24-15-10-5-3-4-6-11-15/h7-9,12H,3-6,10-11,13H2,1-2H3,(H,23,25)InChIKey
PZEJRDAOIXLPBX-UHFFFAOYSA-NSynonyms
714931-87-0(8E)7(2chlorobenzyl)8(cycloheptylidenehydrazinylidene)13dimethyl3789tetrahydro1Hpurine26dione
7((2CHLOROPHENYL)METHYL)8(2CYCLOHEPTYLIDENEHYDRAZINYL)13DIMETHYLPURINE26DIONE
7(2CHLOROBENZYL)8(2CYCLOHEPTYLIDENEHYDRAZINYL)13DIMETHYL37DIHYDRO1HPURINE26DIONE
714931870
Clc1ccccc1Cn1c(=NN=C2CCCCCC2)(nH)c2c1c(=O)n(c(=O)n2C)C
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NN=C3CCCCCC3)CC4=CC=CC=C4Cl
InChI=1SC21H25ClN6O2c1261817(19(29)27(2)21(26)30)28(13149781216(14)22)20(2318)2524151053461115h7912H36101113H212H3(H2325)
MFCD05735086
ZINC000009457624
ZINC09457624
ZINC9457624
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