Vitas-M small molecule compound
8-[(2E)-2-benzylidenehydrazinyl]-3-methyl-7-(4-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK014207
SMILES Cc1ccc(cc1)Cn1c(N/N=C/c2ccccc2)nc2c1c(=O)[nH]c(=O)n2C
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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 C21H20N6O2 MW 388.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N6O2/c1-14-8-10-16(11-9-14)13-27-17-18(26(2)21(29)24-19(17)28)23-20(27)25-22-12-15-6-4-3-5-7-15/h3-12H,13H2,1-2H3,(H,23,25)(H,24,28,29)/b22-12+InChIKey
NFRDMYBRFXETEX-WSDLNYQXSA-NSynonyms
303970-18-5(E)8(2benzylidenehydrazinyl)3methyl7(4methylbenzyl)1Hpurine26(3H7H)dione
303970185
8((2E)2benzylidenehydrazinyl)3methyl7((4methylphenyl)methyl)purine26dione
8((2E)2BENZYLIDENEHYDRAZINYL)3METHYL7(4METHYLBENZYL)37DIHYDRO1HPURINE26DIONE
CC1=CC=C(C=C1)CN2C3=C(N=C2NN=CC4=CC=CC=C4)N(C(=O)NC3=O)C
Cc1ccc(cc1)Cn1c(NN=Cc2ccccc2)nc2c1c(=O)(nH)c(=O)n2C
InChI=1SC21H20N6O2c11481016(11914)13271718(26(2)21(29)2419(17)28)2320(27)252212156435715h312H13H212H3(H2325)(H242829)b2212+
MFCD01556325
STK014207
ZINC000004032268
ZINC33925077
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