Vitas-M small molecule compound

N-(2,1,3-benzothiadiazol-5-yl)-2-[4-(4-ethylbenzyl)piperazin-1-yl]acetamide

Catalog ID
STK483608
SMILES CCc1ccc(cc1)CN1CCN(CC1)CC(=O)Nc1ccc2c(c1)nsn2

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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 C21H25N5OS MW 395.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5OS/c1-2-16-3-5-17(6-4-16)14-25-9-11-26(12-10-25)15-21(27)22-18-7-8-19-20(13-18)24-28-23-19/h3-8,13H,2,9-12,14-15H2,1H3,(H,22,27)
InChIKey
FTRFLAWXBJLBCY-UHFFFAOYSA-N
Synonyms

CCC1=CC=C(C=C1)CN2CCN(CC2)CC(=O)NC3=CC4=NSN=C4C=C3
InChI=1SC21H25N5OSc12163517(6416)142591126(121025)1521(27)2218781920(1318)24282319h3813H29121415H21H3(H2227)
MFCD08593738
N(213benzothiadiazol5yl)2(4((4ethylphenyl)methyl)piperazin1yl)acetamide
N(213benzothiadiazol5yl)2(4(4ethylbenzyl)piperazin1yl)acetamide
NBENZO(C)125THIADIAZOL5YL2(4((4ETHYLPHENYL)METHYL)PIPERAZINYL)ACETAMIDE
ZINC000022752109
ZINC22752109

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Available files

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