Vitas-M small molecule compound

4-benzyl-N-(3,4-dimethoxyphenyl)piperidine-1-carbothioamide

Catalog ID
STK458191
SMILES COc1cc(ccc1OC)NC(=S)N1CCC(CC1)Cc1ccccc1

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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 C21H26N2O2S MW 370.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O2S/c1-24-19-9-8-18(15-20(19)25-2)22-21(26)23-12-10-17(11-13-23)14-16-6-4-3-5-7-16/h3-9,15,17H,10-14H2,1-2H3,(H,22,26)
InChIKey
JACSNWHNOWBYNL-UHFFFAOYSA-N
Synonyms

((34DIMETHOXYPHENYL)AMINO)(4BENZYLPIPERIDYL)METHANE1THIONE
4benzylN(34dimethoxyphenyl)piperidine1carbothioamide
COC1=C(C=C(C=C1)NC(=S)N2CCC(CC2)CC3=CC=CC=C3)OC
InChI=1SC21H26N2O2Sc124199818(1520(19)252)2221(26)23121017(111323)14166435716h391517H1014H212H3(H2226)
MFCD04281959
ZINC000002858722
ZINC02858722
ZINC2858722

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Available files

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