Vitas-M small molecule compound

ethyl 4-{N-[(4-chlorophenyl)sulfonyl]-N-(2-fluorobenzyl)glycyl}piperazine-1-carboxylate

Catalog ID
STK159824
SMILES CCOC(=O)N1CCN(CC1)C(=O)CN(S(=O)(=O)c1ccc(cc1)Cl)Cc1ccccc1F

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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 C22H25ClFN3O5S MW 497.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25ClFN3O5S/c1-2-32-22(29)26-13-11-25(12-14-26)21(28)16-27(15-17-5-3-4-6-20(17)24)33(30,31)19-9-7-18(23)8-10-19/h3-10H,2,11-16H2,1H3
InChIKey
XOUGAZHGJNQNIL-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)C(=O)CN(CC2=CC=CC=C2F)S(=O)(=O)C3=CC=C(C=C3)Cl
ETHYL4(2((4CHLOROPHENYL)SULFONYL((2FLUOROPHENYL)METHYL)AMINO)ACETYL)PIPERAZINE1CARBOXYLATE
ETHYL4(N((4CHLOROPHENYL)SULFONYL)N(2FLUOROBENZYL)GLYCYL)PIPERAZINE1CARBOXYLATE
InChI=1SC22H25ClFN3O5Sc123222(29)26131125(121426)21(28)1627(1517534620(17)24)33(3031)199718(23)81019h310H21116H21H3
MFCD03699286
ZINC000009845864
ZINC09845864
ZINC9845864

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Available files

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