Vitas-M small molecule compound

3-methyl-4-[4-(propan-2-yloxy)phenyl]-1-(pyridin-2-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol

Catalog ID
STL250922
SMILES CC(Oc1ccc(cc1)C1SCC(=Nc2c1c(C)nn2c1ccccn1)O)C

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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 C21H22N4O2S MW 394.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O2S/c1-13(2)27-16-9-7-15(8-10-16)20-19-14(3)24-25(17-6-4-5-11-22-17)21(19)23-18(26)12-28-20/h4-11,13,20H,12H2,1-3H3,(H,23,26)
InChIKey
AFXQBBAUCZVOHK-UHFFFAOYSA-N
Synonyms
1401536-36-4
1401536364
3methyl4(4(propan2yloxy)phenyl)1(pyridin2yl)46dihydro1Hpyrazolo(34e)(14)thiazepin7ol
MFCD24852503
ZINC000079486441
ZINC000079486446

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Available files

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