Vitas-M small molecule compound
1,3-dimethyl-8-[(2E)-2-(3-nitrobenzylidene)hydrazinyl]-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK538841
SMILES CCCn1c(N/N=C/c2cccc(c2)[N+](=O)[O-])nc2c1c(=O)n(c(=O)n2C)C
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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 C17H19N7O4 MW 385.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N7O4/c1-4-8-23-13-14(21(2)17(26)22(3)15(13)25)19-16(23)20-18-10-11-6-5-7-12(9-11)24(27)28/h5-7,9-10H,4,8H2,1-3H3,(H,19,20)/b18-10+InChIKey
ZJGKVFXTIZRIKX-VCHYOVAHSA-NSynonyms
(E)13dimethyl8(2(3nitrobenzylidene)hydrazinyl)7propyl1Hpurine26(3H7H)dione
13dimethyl8((2E)2((3nitrophenyl)methylidene)hydrazinyl)7propylpurine26dione
13dimethyl8((2E)2(3nitrobenzylidene)hydrazinyl)7propyl37dihydro1Hpurine26dione
CCCn1c(NN=Cc2cccc(c2)(N+)(=O)(O))nc2c1c(=O)n(c(=O)n2C)C
CCCN1C2=C(N=C1NN=CC3=CC(=CC=C3)(N+)(=O)(O))N(C(=O)N(C2=O)C)C
InChI=1SC17H19N7O4c148231314(21(2)17(26)22(3)15(13)25)1916(23)2018101165712(911)24(27)28h57910H48H213H3(H1920)b1810+
MFCD02234812
ZINC000016945015
ZINC33335102
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