Vitas-M small molecule compound
4-[(2E)-2-{2-[6-hydroxy-3-methyl-2-oxo-8-(piperidin-1-yl)-2,3-dihydro-7H-purin-7-yl]ethylidene}hydrazinyl]benzoic acid
Catalog ID
STK638856
SMILES OC(=O)c1ccc(cc1)N/N=C/Cn1c(nc2c1c(O)nc(=O)n2C)N1CCCCC1
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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 C20H23N7O4 MW 425.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N7O4/c1-25-16-15(17(28)23-20(25)31)27(19(22-16)26-10-3-2-4-11-26)12-9-21-24-14-7-5-13(6-8-14)18(29)30/h5-9,24H,2-4,10-12H2,1H3,(H,29,30)(H,23,28,31)/b21-9+InChIKey
LUUFZAGRLVKNHC-ZVBGSRNCSA-NSynonyms
372175-88-7372175887
4((2E)2(2(3methyl26dioxo8piperidin1ylpurin7yl)ethylidene)hydrazinyl)benzoicacid
4((2E)2(2(6hydroxy3methyl2oxo8(piperidin1yl)23dihydro7Hpurin7yl)ethylidene)hydrazinyl)benzoicacid
CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCCCC3)CC=NNC4=CC=C(C=C4)C(=O)O
InChI=1SC20H23N7O4c1251615(17(28)2320(25)31)27(19(2216)26103241126)1292124147513(6814)18(29)30h5924H241012H21H3(H2930)(H232831)b219+
MFCD18161810
OC(=O)c1ccc(cc1)NN=CCn1c(nc2c1c(O)nc(=O)n2C)N1CCCCC1
ZINC000009144923
ZINC13142410
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