Vitas-M small molecule compound

N-(4-chlorobenzyl)-4-(2,3-dimethylphenyl)piperazine-1-carbothioamide

Catalog ID
STK472959
SMILES Clc1ccc(cc1)CNC(=S)N1CCN(CC1)c1cccc(c1C)C

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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 C20H24ClN3S MW 373.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24ClN3S/c1-15-4-3-5-19(16(15)2)23-10-12-24(13-11-23)20(25)22-14-17-6-8-18(21)9-7-17/h3-9H,10-14H2,1-2H3,(H,22,25)
InChIKey
MLXWLZZDKBWAHY-UHFFFAOYSA-N
Synonyms

CC1=C(C(=CC=C1)N2CCN(CC2)C(=S)NCC3=CC=C(C=C3)Cl)C
InChI=1SC20H24ClN3Sc11543519(16(15)2)23101224(131123)20(25)2214176818(21)9717h39H1014H212H3(H2225)
MFCD07076939
N((4chlorophenyl)methyl)4(23dimethylphenyl)piperazine1carbothioamide
N(4chlorobenzyl)4(23dimethylphenyl)piperazine1carbothioamide
ZINC000017076539
ZINC17076539

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Available files

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