Vitas-M small molecule compound

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

Catalog ID
STK483874
SMILES CCOc1ccccc1CN1CCN(CC1)CC(=O)Nc1cccc2c1nsn2

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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 C21H25N5O2S MW 411.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O2S/c1-2-28-19-9-4-3-6-16(19)14-25-10-12-26(13-11-25)15-20(27)22-17-7-5-8-18-21(17)24-29-23-18/h3-9H,2,10-15H2,1H3,(H,22,27)
InChIKey
IIDUJUPWHMWUSC-UHFFFAOYSA-N
Synonyms

CCOC1=CC=CC=C1CN2CCN(CC2)CC(=O)NC3=CC=CC4=NSN=C43
InChI=1SC21H25N5O2Sc122819943616(19)1425101226(131125)1520(27)22177581821(17)24292318h39H21015H21H3(H2227)
MFCD08594004
N(213benzothiadiazol4yl)2(4((2ethoxyphenyl)methyl)piperazin1yl)acetamide
N(213benzothiadiazol4yl)2(4(2ethoxybenzyl)piperazin1yl)acetamide
NBENZO(C)125THIADIAZOL4YL2(4((2ETHOXYPHENYL)METHYL)PIPERAZINYL)ACETAMIDE
ZINC000022752393
ZINC22752393

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Available files

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