Vitas-M small molecule compound
7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-8-[(2E)-2-(3-nitrobenzylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL326957
SMILES OC(Cn1c(N/N=C/c2cccc(c2)[N+](=O)[O-])nc2c1c(=O)[nH]c(=O)n2C)COc1ccccc1C
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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 C23H23N7O6 MW 493.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N7O6/c1-14-6-3-4-9-18(14)36-13-17(31)12-29-19-20(28(2)23(33)26-21(19)32)25-22(29)27-24-11-15-7-5-8-16(10-15)30(34)35/h3-11,17,31H,12-13H2,1-2H3,(H,25,27)(H,26,32,33)/b24-11+InChIKey
CLVATPIKKWUNFN-BHGWPJFGSA-NSynonyms
372175-81-0(E)7(2hydroxy3(otolyloxy)propyl)3methyl8(2(3nitrobenzylidene)hydrazinyl)1Hpurine26(3H7H)dione
372175810
7(2hydroxy3(2methylphenoxy)propyl)3methyl8((2E)2((3nitrophenyl)methylidene)hydrazinyl)purine26dione
7(2hydroxy3(2methylphenoxy)propyl)3methyl8((2E)2(3nitrobenzylidene)hydrazinyl)37dihydro1Hpurine26dione
CC1=CC=CC=C1OCC(CN2C3=C(N=C2NN=CC4=CC(=CC=C4)(N+)(=O)(O))N(C(=O)NC3=O)C)O
InChI=1SC23H23N7O6c114634918(14)361317(31)12291920(28(2)23(33)2621(19)32)2522(29)2724111575816(1015)30(34)35h3111731H1213H212H3(H2527)(H263233)b2411+
MFCD01879916
OC(Cn1c(NN=Cc2cccc(c2)(N+)(=O)(O))nc2c1c(=O)(nH)c(=O)n2C)COc1ccccc1C
ZINC000009144921
ZINC000017160659
Check stock
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Check stock on Vitas-MAvailable files
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