Vitas-M small molecule compound
1-[3-(butylsulfanyl)-6-(3-chloro-4-hydroxy-5-methoxyphenyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethanone
Catalog ID
STK980415
SMILES CCCCSc1nnc2c(n1)OC(c1cc(Cl)c(c(c1)OC)O)N(c1c2cccc1)C(=O)C
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 C23H23ClN4O4S MW 486.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23ClN4O4S/c1-4-5-10-33-23-25-21-19(26-27-23)15-8-6-7-9-17(15)28(13(2)29)22(32-21)14-11-16(24)20(30)18(12-14)31-3/h6-9,11-12,22,30H,4-5,10H2,1-3H3InChIKey
PKLRFXKTMYVOCX-UHFFFAOYSA-NSynonyms
1(3(butylsulfanyl)6(3chloro4hydroxy5methoxyphenyl)(124)triazino(56d)(31)benzoxazepin7(6H)yl)ethanone
1(3butylsulfanyl6(3chloro4hydroxy5methoxyphenyl)6H(124)triazino(56d)(31)benzoxazepin7yl)ethanone
CCCCSC1=NC2=C(C3=CC=CC=C3N(C(O2)C4=CC(=C(C(=C4)Cl)O)OC)C(=O)C)N=N1
InChI=1SC23H23ClN4O4Sc145103323252119(262723)15867917(15)28(13(2)29)22(3221)141116(24)20(30)18(1214)313h6911122230H4510H213H3
MFCD18181217
ZINC000044973391
ZINC000044973396
Check stock
See real-time availability and sample size for STK980415 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.