Vitas-M small molecule compound

{1-[(4-ethoxy-3-methylphenyl)sulfonyl]piperidin-4-yl}(4-methylpiperazin-1-yl)methanone

Catalog ID
STL196213
SMILES CCOc1ccc(cc1C)S(=O)(=O)N1CCC(CC1)C(=O)N1CCN(CC1)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 C20H31N3O4S MW 409.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H31N3O4S/c1-4-27-19-6-5-18(15-16(19)2)28(25,26)23-9-7-17(8-10-23)20(24)22-13-11-21(3)12-14-22/h5-6,15,17H,4,7-14H2,1-3H3
InChIKey
ZZDVULPNCFYSIA-UHFFFAOYSA-N
Synonyms

(1((4ethoxy3methylphenyl)sulfonyl)piperidin4yl)(4methylpiperazin1yl)methanone
(1(4ETHOXY3METHYLPHENYL)SULFONYLPIPERIDIN4YL)(4METHYLPIPERAZIN1YL)METHANONE
CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCN(CC3)C)C
InChI=1SC20H31N3O4Sc1427196518(1516(19)2)28(2526)239717(81023)20(24)22131121(3)121422h561517H4714H213H3
MFCD08069276
ZINC000020654033
ZINC20654033

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Available files

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