Vitas-M small molecule compound

6-cyclohexyl-3-(methylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine

Catalog ID
STL497330
SMILES CSc1nnc2c(n1)OC(Nc1c2cccc1)C1CCCCC1

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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 C17H20N4OS MW 328.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4OS/c1-23-17-19-16-14(20-21-17)12-9-5-6-10-13(12)18-15(22-16)11-7-3-2-4-8-11/h5-6,9-11,15,18H,2-4,7-8H2,1H3
InChIKey
VJTJLSTXFBDRRK-UHFFFAOYSA-N
Synonyms

6cyclohexyl3(methylsulfanyl)67dihydro(124)triazino(56d)(31)benzoxazepine
MFCD31538075
ZINC000585655870
ZINC000585655871

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Available files

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