Vitas-M small molecule compound

ethyl 4-[N-(2,4-dichlorobenzyl)-N-(phenylsulfonyl)glycyl]piperazine-1-carboxylate

Catalog ID
STK161753
SMILES CCOC(=O)N1CCN(CC1)C(=O)CN(S(=O)(=O)c1ccccc1)Cc1ccc(cc1Cl)Cl

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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 C22H25Cl2N3O5S MW 514.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25Cl2N3O5S/c1-2-32-22(29)26-12-10-25(11-13-26)21(28)16-27(15-17-8-9-18(23)14-20(17)24)33(30,31)19-6-4-3-5-7-19/h3-9,14H,2,10-13,15-16H2,1H3
InChIKey
MRMGBEZEYMFWAO-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)C(=O)CN(CC2=C(C=C(C=C2)Cl)Cl)S(=O)(=O)C3=CC=CC=C3
ETHYL4(2(BENZENESULFONYL((24DICHLOROPHENYL)METHYL)AMINO)ACETYL)PIPERAZINE1CARBOXYLATE
ETHYL4(N(24DICHLOROBENZYL)N(PHENYLSULFONYL)GLYCYL)PIPERAZINE1CARBOXYLATE
InChI=1SC22H25Cl2N3O5Sc123222(29)26121025(111326)21(28)1627(15178918(23)1420(17)24)33(3031)196435719h3914H210131516H21H3
MFCD03488467
ZINC000009846030
ZINC09846030
ZINC9846030

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Available files

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