Vitas-M small molecule compound

1-[6-(3-ethoxy-2-methoxyphenyl)-3-(hexylsulfanyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethanone

Catalog ID
STK509255
SMILES CCCCCCSc1nnc2c(n1)OC(N(c1c2cccc1)C(=O)C)c1cccc(c1OC)OCC

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 C27H32N4O4S MW 508.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N4O4S/c1-5-7-8-11-17-36-27-28-25-23(29-30-27)19-13-9-10-15-21(19)31(18(3)32)26(35-25)20-14-12-16-22(34-6-2)24(20)33-4/h9-10,12-16,26H,5-8,11,17H2,1-4H3
InChIKey
IMAAWHYBGRBEBM-UHFFFAOYSA-N
Synonyms

1(6(3ethoxy2methoxyphenyl)3(hexylsulfanyl)(124)triazino(56d)(31)benzoxazepin7(6H)yl)ethanone
1(6(3ETHOXY2METHOXYPHENYL)3HEXYLSULFANYL6H(124)TRIAZINO(56D)(31)BENZOXAZEPIN7YL)ETHANONE
7ACETYL6(3ETHOXY2METHOXYPHENYL)3(HEXYLSULFANYL)67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPINE
CCCCCCSC1=NC2=C(C3=CC=CC=C3N(C(O2)C4=C(C(=CC=C4)OCC)OC)C(=O)C)N=N1
InChI=1SC27H32N4O4Sc157811173627282523(293027)19139101521(19)31(18(3)32)26(3525)2014121622(3462)24(20)334h910121626H581117H214H3
MFCD03080375
ZINC000002104699
ZINC000002104701

Check stock

See real-time availability and sample size for STK509255 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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