Vitas-M small molecule compound

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

Catalog ID
STK939133
SMILES OC1=Nc2c(C(SC1)c1cccc(c1)O)c(nn2c1ccccc1)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 C19H17N3O2S MW 351.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O2S/c1-12-17-18(13-6-5-9-15(23)10-13)25-11-16(24)20-19(17)22(21-12)14-7-3-2-4-8-14/h2-10,18,23H,11H2,1H3,(H,20,24)
InChIKey
AFGJRQJGHARHBO-UHFFFAOYSA-N
Synonyms
931343-39-4
4(3hydroxyphenyl)3methyl1phenyl46dihydro1Hpyrazolo(34e)(14)thiazepin7ol
931343394
MFCD18179168
ZINC000020892462
ZINC000020892466

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Available files

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