Vitas-M small molecule compound
7-[(2E)-but-2-en-1-yl]-3-methyl-8-[(2E)-2-(3-nitrobenzylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK700865
SMILES C/C=C/Cn1c(N/N=C/c2cccc(c2)[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 C17H17N7O4 MW 383.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N7O4/c1-3-4-8-23-13-14(22(2)17(26)20-15(13)25)19-16(23)21-18-10-11-6-5-7-12(9-11)24(27)28/h3-7,9-10H,8H2,1-2H3,(H,19,21)(H,20,25,26)/b4-3+,18-10+InChIKey
XYMOZUFEEPTGRZ-DGDUMEAGSA-NSynonyms
306732-93-4306732934
7((2E)but2en1yl)3methyl8((2E)2(3nitrobenzylidene)hydrazinyl)37dihydro1Hpurine26dione
7((2E)BUT2ENYL)8(((1E)2(3NITROPHENYL)1AZAVINYL)AMINO)3METHYL137TRIHYDROPURINE26DIONE
7((E)but2en1yl)3methyl8((E)2(3nitrobenzylidene)hydrazinyl)1Hpurine26(3H7H)dione
7((E)but2enyl)3methyl8((2E)2((3nitrophenyl)methylidene)hydrazinyl)purine26dione
CC=CCn1c(NN=Cc2cccc(c2)(N+)(=O)(O))nc2c1c(=O)(nH)c(=O)n2C
CC=CCN1C2=C(N=C1NN=CC3=CC(=CC=C3)(N+)(=O)(O))N(C(=O)NC2=O)C
InChI=1SC17H17N7O4c1348231314(22(2)17(26)2015(13)25)1916(23)2118101165712(911)24(27)28h37910H8H212H3(H1921)(H202526)b43+1810+
MFCD01543212
ZINC000017969605
ZINC32117021
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