Vitas-M small molecule compound
4-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]phenolate
Catalog ID
STL042629
SMILES CN(C1CCCCC1)Cc1c(nnn1c1nonc1[NH3+])C(=O)N/N=C/c1ccc(cc1)[O-]
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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 C20H25N9O3 MW 439.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N9O3/c1-28(14-5-3-2-4-6-14)12-16-17(23-27-29(16)19-18(21)25-32-26-19)20(31)24-22-11-13-7-9-15(30)10-8-13/h7-11,14,30H,2-6,12H2,1H3,(H2,21,25)(H,24,31)/b22-11+InChIKey
BTKCXXKARWLQSX-SSDVNMTOSA-NSynonyms
849034-85-1849034851
CN(C1CCCCC1)Cc1c(nnn1c1nonc1(NH3+))C(=O)NN=Cc1ccc(cc1)(O)
MFCD05682287
ZINC000002604895
Check stock
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Check stock on Vitas-MAvailable files
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