Vitas-M small molecule compound

N-{4-[4-(2-fluorobenzyl)piperazin-1-yl]phenyl}-2,1,3-benzothiadiazole-4-carboxamide

Catalog ID
STK220411
SMILES Fc1ccccc1CN1CCN(CC1)c1ccc(cc1)NC(=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 C24H22FN5OS MW 447.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22FN5OS/c25-21-6-2-1-4-17(21)16-29-12-14-30(15-13-29)19-10-8-18(9-11-19)26-24(31)20-5-3-7-22-23(20)28-32-27-22/h1-11H,12-16H2,(H,26,31)
InChIKey
NVCWRAUWMCPHGG-UHFFFAOYSA-N
Synonyms

C1CN(CCN1CC2=CC=CC=C2F)C3=CC=C(C=C3)NC(=O)C4=CC=CC5=NSN=C54
InChI=1SC24H22FN5OSc2521621417(21)1629121430(151329)1910818(91119)2624(31)205372223(20)28322722h111H1216H2(H2631)
MFCD08683010
N(4(4((2fluorophenyl)methyl)piperazin1yl)phenyl)213benzothiadiazole4carboxamide
N(4(4(2fluorobenzyl)piperazin1yl)phenyl)213benzothiadiazole4carboxamide
ZINC000057238698
ZINC57238698

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Available files

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