Vitas-M small molecule compound

[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl](2-bromophenyl)methanone

Catalog ID
STK718263
SMILES Brc1ccccc1C(=O)N1CCN(CC1)S(=O)(=O)c1cccc2c1nsn2

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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 C17H15BrN4O3S2 MW 467.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15BrN4O3S2/c18-13-5-2-1-4-12(13)17(23)21-8-10-22(11-9-21)27(24,25)15-7-3-6-14-16(15)20-26-19-14/h1-7H,8-11H2
InChIKey
BTIKIUJIAUWGPK-UHFFFAOYSA-N
Synonyms
1010912-11-4
(4(213benzothiadiazol4ylsulfonyl)piperazin1yl)(2bromophenyl)methanone
(4(benzo(c)(125)thiadiazol4ylsulfonyl)piperazin1yl)(2bromophenyl)methanone
1010912114
C1CN(CCN1C(=O)C2=CC=CC=C2Br)S(=O)(=O)C3=CC=CC4=NSN=C43
InChI=1SC17H15BrN4O3S2c1813521412(13)17(23)2181022(11921)27(2425)157361416(15)20261914h17H811H2
MFCD12204936
ZINC000012409692
ZINC12409692

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Available files

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