Vitas-M small molecule compound

2-[(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]-4-chlorophenolate

Catalog ID
STL055102
SMILES CN(C1CCCCC1)Cc1c(nnn1c1nonc1[NH3+])C(=O)N/N=C/c1cc(Cl)ccc1[O-]

Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.

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 C20H24ClN9O3 MW 473.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24ClN9O3/c1-29(14-5-3-2-4-6-14)11-15-17(24-28-30(15)19-18(22)26-33-27-19)20(32)25-23-10-12-9-13(21)7-8-16(12)31/h7-10,14,31H,2-6,11H2,1H3,(H2,22,26)(H,25,32)/b23-10+
InChIKey
JLWDKYQUOVVPGE-AUEPDCJTSA-N
Synonyms
849035-00-3
2((E)((1(4azaniumyl125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)triazole4carbonyl)hydrazinylidene)methyl)4chlorophenolate
2((E)(2((1(4ammonio125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)1H123triazol4yl)carbonyl)hydrazinylidene)methyl)4chlorophenolate
849035003
CN(C1CCCCC1)Cc1c(nnn1c1nonc1(NH3+))C(=O)NN=Cc1cc(Cl)ccc1(O)
CN(CC1=C(N=NN1C2=NON=C2(NH3+))C(=O)NN=CC3=C(C=CC(=C3)Cl)(O))C4CCCCC4
InChI=1SC20H24ClN9O3c129(145324614)111517(242830(15)1918(22)26332719)20(32)25231012913(21)7816(12)31h7101431H2611H21H3(H22226)(H2532)b2310+
MFCD05682304
ZINC000001882696

Check stock

See real-time availability and sample size for STL055102 on the Vitas-M platform.

Check stock on Vitas-M

Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.