Vitas-M small molecule compound

N-(4-chlorobenzyl)-4-[(3,4-dimethylphenyl)sulfonyl]piperazine-1-carbothioamide

Catalog ID
STK472986
SMILES Clc1ccc(cc1)CNC(=S)N1CCN(CC1)S(=O)(=O)c1ccc(c(c1)C)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 C20H24ClN3O2S2 MW 438.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24ClN3O2S2/c1-15-3-8-19(13-16(15)2)28(25,26)24-11-9-23(10-12-24)20(27)22-14-17-4-6-18(21)7-5-17/h3-8,13H,9-12,14H2,1-2H3,(H,22,27)
InChIKey
IKGGTZPQSPVDGK-UHFFFAOYSA-N
Synonyms

1((34DIMETHYLPHENYL)SULFONYL)4((((4CHLOROPHENYL)METHYL)AMINO)THIOXOMETHYL)PIPERAZINE
CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NCC3=CC=C(C=C3)Cl)C
InChI=1SC20H24ClN3O2S2c1153819(1316(15)2)28(2526)2411923(101224)20(27)2214174618(21)7517h3813H91214H212H3(H2227)
MFCD07081631
N((4chlorophenyl)methyl)4(34dimethylphenyl)sulfonylpiperazine1carbothioamide
N(4chlorobenzyl)4((34dimethylphenyl)sulfonyl)piperazine1carbothioamide
ZINC000017101852
ZINC17101852

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Available files

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