Vitas-M small molecule compound
3-methyl-8-[(2E)-2-(4-nitrobenzylidene)hydrazinyl]-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK528129
SMILES CCCn1c(N/N=C/c2ccc(cc2)[N+](=O)[O-])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 C16H17N7O4 MW 371.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N7O4/c1-3-8-22-12-13(21(2)16(25)19-14(12)24)18-15(22)20-17-9-10-4-6-11(7-5-10)23(26)27/h4-7,9H,3,8H2,1-2H3,(H,18,20)(H,19,24,25)/b17-9+InChIKey
KQKOTDDTYKBMQG-RQZCQDPDSA-NSynonyms
329700-72-3(E)3methyl8(2(4nitrobenzylidene)hydrazinyl)7propyl1Hpurine26(3H7H)dione
329700723
3METHYL8((2E)2((4NITROPHENYL)METHYLIDENE)HYDRAZINYL)7PROPYLPURINE26DIONE
3methyl8((2E)2(4nitrobenzylidene)hydrazinyl)7propyl37dihydro1Hpurine26dione
CCCn1c(NN=Cc2ccc(cc2)(N+)(=O)(O))nc2c1c(=O)(nH)c(=O)n2C
CCCN1C2=C(N=C1NN=CC3=CC=C(C=C3)(N+)(=O)(O))N(C(=O)NC2=O)C
InChI=1SC16H17N7O4c138221213(21(2)16(25)1914(12)24)1815(22)20179104611(7510)23(26)27h479H38H212H3(H1820)(H192425)b179+
MFCD01552854
ZINC000016944312
ZINC33335086
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