Vitas-M small molecule compound

[1-(benzylsulfonyl)piperidin-4-yl][4-(2,3-dimethylphenyl)piperazin-1-yl]methanone

Catalog ID
STL116080
SMILES O=C(N1CCN(CC1)c1cccc(c1C)C)C1CCN(CC1)S(=O)(=O)Cc1ccccc1

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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 C25H33N3O3S MW 455.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33N3O3S/c1-20-7-6-10-24(21(20)2)26-15-17-27(18-16-26)25(29)23-11-13-28(14-12-23)32(30,31)19-22-8-4-3-5-9-22/h3-10,23H,11-19H2,1-2H3
InChIKey
FCRZSSLJKMUXGQ-UHFFFAOYSA-N
Synonyms

(1(benzylsulfonyl)piperidin4yl)(4(23dimethylphenyl)piperazin1yl)methanone
(1benzylsulfonylpiperidin4yl)(4(23dimethylphenyl)piperazin1yl)methanone
CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4)C
InChI=1SC25H33N3O3Sc120761024(21(20)2)26151727(181626)25(29)23111328(141223)32(3031)19228435922h31023H1119H212H3
MFCD14822647
ZINC000008587466
ZINC8587466

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Available files

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