Vitas-M small molecule compound

N-[2-(4-methoxyphenyl)ethyl]-4-[(4-methoxyphenyl)sulfonyl]piperazine-1-carbothioamide

Catalog ID
STK447332
SMILES COc1ccc(cc1)CCNC(=S)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)OC

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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 C21H27N3O4S2 MW 449.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O4S2/c1-27-18-5-3-17(4-6-18)11-12-22-21(29)23-13-15-24(16-14-23)30(25,26)20-9-7-19(28-2)8-10-20/h3-10H,11-16H2,1-2H3,(H,22,29)
InChIKey
QBRWHUFIBCWSAC-UHFFFAOYSA-N
Synonyms

4(((2(4METHOXYPHENYL)ETHYL)AMINO)THIOXOMETHYL)1((4METHOXYPHENYL)SULFONYL)PIPERAZINE
COC1=CC=C(C=C1)CCNC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC
InChI=1SC21H27N3O4S2c127185317(4618)11122221(29)23131524(161423)30(2526)209719(282)81020h310H1116H212H3(H2229)
MFCD04059945
N(2(4methoxyphenyl)ethyl)4((4methoxyphenyl)sulfonyl)piperazine1carbothioamide
N(2(4methoxyphenyl)ethyl)4(4methoxyphenyl)sulfonylpiperazine1carbothioamide
ZINC000016277131
ZINC16277131

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Available files

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