Vitas-M small molecule compound
1-(4-nitrobenzyl)-1,9-dihydro-6H-purin-6-one
Catalog ID
STK759940
SMILES [O-][N+](=O)c1ccc(cc1)Cn1cnc2c(c1=O)nc[nH]2
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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 C12H9N5O3 MW 271.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9N5O3/c18-12-10-11(14-6-13-10)15-7-16(12)5-8-1-3-9(4-2-8)17(19)20/h1-4,6-7H,5H2,(H,13,14)InChIKey
BLRIXZNYJMLUQG-UHFFFAOYSA-NSynonyms
74539-06-3(O)(N+)(=O)c1ccc(cc1)Cn1cnc2c(c1=O)nc(nH)2
1((4NITROPHENYL)METHYL)7HPURIN6ONE
1(4nitrobenzyl)19dihydro6Hpurin6one
1(4NITROBENZYL)HYPOXANTHINE
74539063
C1=CC(=CC=C1CN2C=NC3=C(C2=O)NC=N3)(N+)(=O)(O)
InChI=1SC12H9N5O3c18121011(1461310)15716(12)58139(428)17(19)20h1467H5H2(H1314)
MFCD01346713
ZINC000000052561
ZINC00052561
ZINC52561
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