Vitas-M small molecule compound

1-(2-chloro-5-fluorophenyl)-4-(1-methyl-1H-pyrazol-4-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol

Catalog ID
STL313000
SMILES Fc1ccc(c(c1)n1ncc2c1N=C(O)CSC2c1cnn(c1)C)Cl

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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 C16H13ClFN5OS MW 377.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClFN5OS/c1-22-7-9(5-19-22)15-11-6-20-23(16(11)21-14(24)8-25-15)13-4-10(18)2-3-12(13)17/h2-7,15H,8H2,1H3,(H,21,24)
InChIKey
VRGHLCIKXJIDCA-UHFFFAOYSA-N
Synonyms
1401597-58-7
1(2chloro5fluorophenyl)4(1methyl1Hpyrazol4yl)46dihydro1Hpyrazolo(34e)(14)thiazepin7ol
1401597587
MFCD28029855
ZINC000079502159
ZINC000079502161

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Available files

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