Vitas-M small molecule compound

N-(4-bromo-2-chlorophenyl)-4-(2-ethoxyphenyl)piperazine-1-carbothioamide

Catalog ID
STK457313
SMILES CCOc1ccccc1N1CCN(CC1)C(=S)Nc1ccc(cc1Cl)Br

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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 C19H21BrClN3OS MW 454.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21BrClN3OS/c1-2-25-18-6-4-3-5-17(18)23-9-11-24(12-10-23)19(26)22-16-8-7-14(20)13-15(16)21/h3-8,13H,2,9-12H2,1H3,(H,22,26)
InChIKey
PUMGBLBKRAENPC-UHFFFAOYSA-N
Synonyms

((4BROMO2CHLOROPHENYL)AMINO)(4(2ETHOXYPHENYL)PIPERAZINYL)METHANE1THIONE
CCOC1=CC=CC=C1N2CCN(CC2)C(=S)NC3=C(C=C(C=C3)Br)Cl
InChI=1SC19H21BrClN3OSc122518643517(18)2391124(121023)19(26)22168714(20)1315(16)21h3813H2912H21H3(H2226)
MFCD05100989
N(4bromo2chlorophenyl)4(2ethoxyphenyl)piperazine1carbothioamide
ZINC000002857265
ZINC02857265
ZINC2857265

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Available files

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