Vitas-M small molecule compound

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

Catalog ID
STL317463
SMILES Oc1ccc(cc1)C1SCC(=Nc2c1cnn2Cc1ccccc1Cl)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 C19H16ClN3O2S MW 385.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClN3O2S/c20-16-4-2-1-3-13(16)10-23-19-15(9-21-23)18(26-11-17(25)22-19)12-5-7-14(24)8-6-12/h1-9,18,24H,10-11H2,(H,22,25)
InChIKey
UPJGPUPIGSJQHY-UHFFFAOYSA-N
Synonyms
1435977-28-8
1(2chlorobenzyl)4(4hydroxyphenyl)46dihydro1Hpyrazolo(34e)(14)thiazepin7ol
1435977288
MFCD28028396
ZINC000095478553
ZINC000095478554

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Available files

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