Vitas-M small molecule compound

[4-(1,1-dioxido-1,2-benzothiazol-3-yl)piperazin-1-yl](pyridin-3-yl)methanone

Catalog ID
STK094375
SMILES O=C(c1cccnc1)N1CCN(CC1)C1=NS(=O)(=O)c2c1cccc2

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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 C17H16N4O3S MW 356.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O3S/c22-17(13-4-3-7-18-12-13)21-10-8-20(9-11-21)16-14-5-1-2-6-15(14)25(23,24)19-16/h1-7,12H,8-11H2
InChIKey
MZMFVIGSTYMSHD-UHFFFAOYSA-N
Synonyms

(4(11DIOXIDO12BENZOTHIAZOL3YL)PIPERAZIN1YL)(PYRIDIN3YL)METHANONE
(4(11DIOXO12BENZOTHIAZOL3YL)PIPERAZIN1YL)PYRIDIN3YLMETHANONE
3(4(PYRIDIN3YLCARBONYL)PIPERAZIN1YL)12BENZISOTHIAZOLE11DIOXIDE
C1CN(CCN1C2=NS(=O)(=O)C3=CC=CC=C32)C(=O)C4=CN=CC=C4
InChI=1SC17H16N4O3Sc2217(13437181213)2110820(91121)1614512615(14)25(2324)1916h1712H811H2
MFCD04084652
O=C(c1cccnc1)N1CCN(CC1)C1=NS(=O)(=O)c2c1cccc2
STK094375
ZINC000001405804
ZINC01405804
ZINC1405804

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Available files

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