Vitas-M small molecule compound
6-[2-(benzyloxy)-5-bromophenyl]-3-(pentylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Catalog ID
STL169890
SMILES CCCCCSc1nnc2c(n1)OC(Nc1c2cccc1)c1cc(Br)ccc1OCc1ccccc1
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 C28H27BrN4O2S MW 563.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27BrN4O2S/c1-2-3-9-16-36-28-31-27-25(32-33-28)21-12-7-8-13-23(21)30-26(35-27)22-17-20(29)14-15-24(22)34-18-19-10-5-4-6-11-19/h4-8,10-15,17,26,30H,2-3,9,16,18H2,1H3InChIKey
KCWPIERBUCFELR-UHFFFAOYSA-NSynonyms
353786-47-7353786477
6(2(benzyloxy)5bromophenyl)3(pentylsulfanyl)67dihydro(124)triazino(56d)(31)benzoxazepine
6(5BROMO2PHENYLMETHOXYPHENYL)3PENTYLSULFANYL67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPINE
CCCCCSC1=NC2=C(C3=CC=CC=C3NC(O2)C4=C(C=CC(=C4)Br)OCC5=CC=CC=C5)N=N1
InChI=1SC28H27BrN4O2Sc1239163628312725(323328)2112781323(21)3026(3527)221720(29)141524(22)341819105461119h481015172630H2391618H21H3
MFCD01835115
ZINC000002085514
ZINC000002085515
Check stock
See real-time availability and sample size for STL169890 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.