Vitas-M small molecule compound

4-(2-ethoxyphenyl)-1,3-diphenyl-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol

Catalog ID
STL056228
SMILES CCOc1ccccc1C1SCC(=Nc2c1c(nn2c1ccccc1)c1ccccc1)O

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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 C26H23N3O2S MW 441.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N3O2S/c1-2-31-21-16-10-9-15-20(21)25-23-24(18-11-5-3-6-12-18)28-29(19-13-7-4-8-14-19)26(23)27-22(30)17-32-25/h3-16,25H,2,17H2,1H3,(H,27,30)
InChIKey
GAPYMQQAQIIGEK-UHFFFAOYSA-N
Synonyms
714922-42-6
4(2ethoxyphenyl)13diphenyl46dihydro1Hpyrazolo(34e)(14)thiazepin7ol
714922426
MFCD05733400
ZINC000002443916
ZINC000002443919

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Available files

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