Vitas-M small molecule compound
3-methyl-8-[(2E)-2-(3-nitrobenzylidene)hydrazinyl]-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK007098
SMILES [O-][N+](=O)c1cccc(c1)/C=N/Nc1nc2c(n1CCc1ccccc1)c(=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 C21H19N7O4 MW 433.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N7O4/c1-26-18-17(19(29)24-21(26)30)27(11-10-14-6-3-2-4-7-14)20(23-18)25-22-13-15-8-5-9-16(12-15)28(31)32/h2-9,12-13H,10-11H2,1H3,(H,23,25)(H,24,29,30)/b22-13+InChIKey
DFVVOBWOZNCTOF-LPYMAVHISA-NSynonyms
304870-07-3(E)3methyl8(2(3nitrobenzylidene)hydrazinyl)7phenethyl1Hpurine26(3H7H)dione
(O)(N+)(=O)c1cccc(c1)C=NNc1nc2c(n1CCc1ccccc1)c(=O)(nH)c(=O)n2C
304870073
3methyl8((2E)2((3nitrophenyl)methylidene)hydrazinyl)7(2phenylethyl)purine26dione
3METHYL8((2E)2(3NITROBENZYLIDENE)HYDRAZINYL)7(2PHENYLETHYL)37DIHYDRO1HPURINE26DIONE
CN1C2=C(C(=O)NC1=O)N(C(=N2)NN=CC3=CC(=CC=C3)(N+)(=O)(O))CCC4=CC=CC=C4
InChI=1SC21H19N7O4c1261817(19(29)2421(26)30)27(1110146324714)20(2318)2522131585916(1215)28(31)32h291213H1011H21H3(H2325)(H242930)b2213+
MFCD01051220
STK007098
ZINC000008916449
ZINC33851162
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