Vitas-M small molecule compound

1-cyclooctyl-6-methyl-4-(trifluoromethyl)-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3-ol

Catalog ID
STL252275
SMILES CC1=Nc2c(C(S1)C(F)(F)F)c(nn2C1CCCCCCC1)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 C15H20F3N3OS MW 347.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H20F3N3OS/c1-9-19-13-11(12(23-9)15(16,17)18)14(22)20-21(13)10-7-5-3-2-4-6-8-10/h10,12H,2-8H2,1H3,(H,20,22)
InChIKey
SQDLBWZXFRNYNV-UHFFFAOYSA-N
Synonyms
1324090-29-0
1324090290
1cyclooctyl6methyl4(trifluoromethyl)14dihydropyrazolo(34d)(13)thiazin3ol
1cyclooctyl6methyl4(trifluoromethyl)24dihydropyrazolo(34d)(13)thiazin3one
CC1=NC2=C(C(S1)C(F)(F)F)C(=O)NN2C3CCCCCCC3
InChI=1SC15H20F3N3OSc19191311(12(239)15(1617)18)14(22)2021(13)10753246810h1012H28H21H3(H2022)
MFCD24852914
ZINC000071286762
ZINC000071286764

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Available files

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