Vitas-M small molecule compound

[4-(2,3-dimethylphenyl)piperazin-1-yl]{1-[(4-fluorobenzyl)sulfonyl]piperidin-4-yl}methanone

Catalog ID
STL117169
SMILES Fc1ccc(cc1)CS(=O)(=O)N1CCC(CC1)C(=O)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 C25H32FN3O3S MW 473.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32FN3O3S/c1-19-4-3-5-24(20(19)2)27-14-16-28(17-15-27)25(30)22-10-12-29(13-11-22)33(31,32)18-21-6-8-23(26)9-7-21/h3-9,22H,10-18H2,1-2H3
InChIKey
NRLZALBSOQIKGM-UHFFFAOYSA-N
Synonyms

(4(23dimethylphenyl)piperazin1yl)(1((4fluorobenzyl)sulfonyl)piperidin4yl)methanone
(4(23dimethylphenyl)piperazin1yl)(1((4fluorophenyl)methylsulfonyl)piperidin4yl)methanone
CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)CC4=CC=C(C=C4)F)C
InChI=1SC25H32FN3O3Sc11943524(20(19)2)27141628(171527)25(30)22101229(131122)33(3132)18216823(26)9721h3922H1018H212H3
MFCD14824001
ZINC000024609826
ZINC24609826

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Available files

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