Vitas-M small molecule compound

4-[(4-chlorophenyl)sulfonyl]-N-(2-methoxy-5-methylphenyl)piperazine-1-carbothioamide

Catalog ID
STK456741
SMILES COc1ccc(cc1NC(=S)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)Cl)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 C19H22ClN3O3S2 MW 439.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22ClN3O3S2/c1-14-3-8-18(26-2)17(13-14)21-19(27)22-9-11-23(12-10-22)28(24,25)16-6-4-15(20)5-7-16/h3-8,13H,9-12H2,1-2H3,(H,21,27)
InChIKey
JDHJQZOPYQUBLN-UHFFFAOYSA-N
Synonyms

4((4chlorophenyl)sulfonyl)N(2methoxy5methylphenyl)piperazine1carbothioamide
4(4CHLOROPHENYL)SULFONYLN(2METHOXY5METHYLPHENYL)PIPERAZINE1CARBOTHIOAMIDE
4CHLORO1((4(((2METHOXY5METHYLPHENYL)AMINO)THIOXOMETHYL)PIPERAZINYL)SULFONYL)BENZENE
CC1=CC(=C(C=C1)OC)NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
InChI=1SC19H22ClN3O3S2c1143818(262)17(1314)2119(27)2291123(121022)28(2425)166415(20)5716h3813H912H212H3(H2127)
MFCD05055792
ZINC000002853504
ZINC02853504
ZINC2853504

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Available files

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