Vitas-M small molecule compound

1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-2-(4-chlorophenyl)ethanone

Catalog ID
STK718260
SMILES Clc1ccc(cc1)CC(=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 C18H17ClN4O3S2 MW 436.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN4O3S2/c19-14-6-4-13(5-7-14)12-17(24)22-8-10-23(11-9-22)28(25,26)16-3-1-2-15-18(16)21-27-20-15/h1-7H,8-12H2
InChIKey
GYBYRJOINZYAQV-UHFFFAOYSA-N
Synonyms
1010906-26-9
1(4(213benzothiadiazol4ylsulfonyl)piperazin1yl)2(4chlorophenyl)ethanone
1(4(benzo(c)(125)thiadiazol4ylsulfonyl)piperazin1yl)2(4chlorophenyl)ethanone
1010906269
C1CN(CCN1C(=O)CC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC4=NSN=C43
InChI=1SC18H17ClN4O3S2c19146413(5714)1217(24)2281023(11922)28(2526)163121518(16)21272015h17H812H2
MFCD12199655
ZINC000012322087
ZINC12322087

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Available files

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