Vitas-M small molecule compound

4-(2,6-dichlorobenzyl)-N-(3-methoxypropyl)piperazine-1-carbothioamide

Catalog ID
STK484430
SMILES COCCCNC(=S)N1CCN(CC1)Cc1c(Cl)cccc1Cl

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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 C16H23Cl2N3OS MW 376.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23Cl2N3OS/c1-22-11-3-6-19-16(23)21-9-7-20(8-10-21)12-13-14(17)4-2-5-15(13)18/h2,4-5H,3,6-12H2,1H3,(H,19,23)
InChIKey
ZGLMNNMTOGUDIV-UHFFFAOYSA-N
Synonyms

(4((26DICHLOROPHENYL)METHYL)PIPERAZINYL)((3METHOXYPROPYL)AMINO)METHANE1THIONE
4((26dichlorophenyl)methyl)N(3methoxypropyl)piperazine1carbothioamide
4(26dichlorobenzyl)N(3methoxypropyl)piperazine1carbothioamide
COCCCNC(=S)N1CCN(CC1)CC2=C(C=CC=C2Cl)Cl
InChI=1SC16H23Cl2N3OSc12211361916(23)219720(81021)121314(17)42515(13)18h245H3612H21H3(H1923)
MFCD06146791
ZINC000013325942
ZINC13325942

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Available files

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