Vitas-M small molecule compound

ethyl 4-{[1-(benzylsulfonyl)piperidin-4-yl]carbonyl}piperazine-1-carboxylate

Catalog ID
STL116116
SMILES CCOC(=O)N1CCN(CC1)C(=O)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 C20H29N3O5S MW 423.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H29N3O5S/c1-2-28-20(25)22-14-12-21(13-15-22)19(24)18-8-10-23(11-9-18)29(26,27)16-17-6-4-3-5-7-17/h3-7,18H,2,8-16H2,1H3
InChIKey
IRQALLGMGFJYFI-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3
ethyl4((1(benzylsulfonyl)piperidin4yl)carbonyl)piperazine1carboxylate
ethyl4(1benzylsulfonylpiperidine4carbonyl)piperazine1carboxylate
InChI=1SC20H29N3O5Sc122820(25)22141221(131522)19(24)1881023(11918)29(2627)16176435717h3718H2816H21H3
MFCD14822517
ZINC000020898340
ZINC20898340

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Available files

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