Vitas-M small molecule compound
3-[4-(acetyloxy)butyl]-1-phenyl-4-(phenylcarbamoyl)-1H-1,2,3-triazol-3-ium-5-olate
Catalog ID
STL441163
SMILES CC(=O)OCCCC[n+]1nn(c(c1C(=O)Nc1ccccc1)[O-])c1ccccc1
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 C21H22N4O4 MW 394.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O4/c1-16(26)29-15-9-8-14-24-19(20(27)22-17-10-4-2-5-11-17)21(28)25(23-24)18-12-6-3-7-13-18/h2-7,10-13H,8-9,14-15H2,1H3,(H-,22,23,27,28)InChIKey
IHUJRSYYICBIMS-UHFFFAOYSA-NSynonyms
1(4(ACETYLOXY)BUTYL)5(ANILINOCARBONYL)3PHENYL3H123TRIAZOL1IUM4OLATE
1(4ACETYLOXYBUTYL)3PHENYL5(PHENYLCARBAMOYL)TRIAZOL1IUM4OLATE
3(4(acetyloxy)butyl)1phenyl4(phenylcarbamoyl)1H123triazol3ium5olate
CC(=O)OCCCC(N+)1=NN(C(=C1C(=O)NC2=CC=CC=C2)(O))C3=CC=CC=C3
CC(=O)OCCCC(n+)1nn(c(c1C(=O)Nc1ccccc1)(O))c1ccccc1
InChI=1SC21H22N4O4c116(26)291598142419(20(27)2217104251117)21(28)25(2324)18126371318h271013H891415H21H3(H22232728)
MFCD07773671
ZINC000003765435
ZINC03765435
Check stock
See real-time availability and sample size for STL441163 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.