Vitas-M small molecule compound
8-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-6-hydroxy-3-methyl-7-pentyl-3,7-dihydro-2H-purin-2-one
Catalog ID
STK640047
SMILES CCCCCn1c(N/N=C/c2ccc(cc2)Br)nc2c1c(O)nc(=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 C18H21BrN6O2 MW 433.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21BrN6O2/c1-3-4-5-10-25-14-15(24(2)18(27)22-16(14)26)21-17(25)23-20-11-12-6-8-13(19)9-7-12/h6-9,11H,3-5,10H2,1-2H3,(H,21,23)(H,22,26,27)/b20-11+InChIKey
OFLGEOJVJWWQBH-RGVLZGJSSA-NSynonyms
8((2E)2((4BROMOPHENYL)METHYLIDENE)HYDRAZINYL)3METHYL7PENTYLPURINE26DIONE
8((2E)2(4bromobenzylidene)hydrazinyl)6hydroxy3methyl7pentyl37dihydro2Hpurin2one
CCCCCn1c(NN=Cc2ccc(cc2)Br)nc2c1c(O)nc(=O)n2C
CCCCCN1C2=C(N=C1NN=CC3=CC=C(C=C3)Br)N(C(=O)NC2=O)C
InChI=1SC18H21BrN6O2c134510251415(24(2)18(27)2216(14)26)2117(25)232011126813(19)9712h6911H3510H212H3(H2123)(H222627)b2011+
MFCD18162205
ZINC000006149706
ZINC31857589
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