Vitas-M small molecule compound

[2-(cyclohexylamino)-4-methyl-1,3-thiazol-5-yl](3,5-dimethyl-1H-pyrazol-1-yl)methanone

Catalog ID
STL080948
SMILES Cc1nn(c(c1)C)C(=O)c1sc(nc1C)NC1CCCCC1

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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 C16H22N4OS MW 318.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N4OS/c1-10-9-11(2)20(19-10)15(21)14-12(3)17-16(22-14)18-13-7-5-4-6-8-13/h9,13H,4-8H2,1-3H3,(H,17,18)
InChIKey
LAKIIBLWLRAOJW-UHFFFAOYSA-N
Synonyms
1255784-07-6
(2(cyclohexylamino)4methyl13thiazol5yl)(35dimethyl1Hpyrazol1yl)methanone
(2(cyclohexylamino)4methyl13thiazol5yl)(35dimethylpyrazol1yl)methanone
1255784076
CC1=CC(=NN1C(=O)C2=C(N=C(S2)NC3CCCCC3)C)C
InChI=1SC16H22N4OSc110911(2)20(1910)15(21)1412(3)1716(2214)18137546813h913H48H213H3(H1718)
MFCD17780156
ZINC000057352043
ZINC57352043

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Available files

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