Vitas-M small molecule compound

3-methyl-N-[(2Z)-6-(methylsulfonyl)-1,3-benzothiazol-2(3H)-ylidene]butanamide

Catalog ID
STK584948
SMILES CC(CC(=O)/N=c/1\sc2c([nH]1)ccc(c2)S(=O)(=O)C)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 C13H16N2O3S2 MW 312.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2O3S2/c1-8(2)6-12(16)15-13-14-10-5-4-9(20(3,17)18)7-11(10)19-13/h4-5,7-8H,6H2,1-3H3,(H,14,15,16)
InChIKey
XPUZTISBOPKWFN-UHFFFAOYSA-N
Synonyms
349540-64-3
CC(CC(=O)N=c1sc2c((nH)1)ccc(c2)S(=O)(=O)C)C
MFCD07209619
ZINC000009015671

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Available files

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