Vitas-M small molecule compound
7-(2-hydroxyethyl)-3-methyl-8-[(2E)-2-(3-nitrobenzylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL335422
SMILES OCCn1c(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 C15H15N7O5 MW 373.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15N7O5/c1-20-12-11(13(24)18-15(20)25)21(5-6-23)14(17-12)19-16-8-9-3-2-4-10(7-9)22(26)27/h2-4,7-8,23H,5-6H2,1H3,(H,17,19)(H,18,24,25)/b16-8+InChIKey
MGHGPLHKYMSLMO-LZYBPNLTSA-NSynonyms
115294-91-2(E)7(2hydroxyethyl)3methyl8(2(3nitrobenzylidene)hydrazinyl)1Hpurine26(3H7H)dione
115294912
7(2hydroxyethyl)3methyl8((2E)2((3nitrophenyl)methylidene)hydrazinyl)purine26dione
7(2hydroxyethyl)3methyl8((2E)2(3nitrobenzylidene)hydrazinyl)37dihydro1Hpurine26dione
CN1C2=C(C(=O)NC1=O)N(C(=N2)NN=CC3=CC(=CC=C3)(N+)(=O)(O))CCO
InChI=1SC15H15N7O5c1201211(13(24)1815(20)25)21(5623)14(1712)19168932410(79)22(26)27h247823H56H21H3(H1719)(H182425)b168+
MFCD01084722
OCCn1c(NN=Cc2cccc(c2)(N+)(=O)(O))nc2c1c(=O)(nH)c(=O)n2C
ZINC000008995437
ZINC33366101
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