Vitas-M small molecule compound

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

Catalog ID
STK030521
SMILES CCOC(=O)N1CCN(CC1)C(=O)CN(S(=O)(=O)c1ccc(cc1)C)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 C23H28FN3O5S MW 477.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28FN3O5S/c1-3-32-23(29)26-14-12-25(13-15-26)22(28)17-27(16-19-6-4-5-7-21(19)24)33(30,31)20-10-8-18(2)9-11-20/h4-11H,3,12-17H2,1-2H3
InChIKey
BZHLZEHGNYQVRM-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)C(=O)CN(CC2=CC=CC=C2F)S(=O)(=O)C3=CC=C(C=C3)C
CCOC(=O)N1CCN(CC1)C(=O)CN(S(=O)(=O)c1ccc(cc1)C)Cc1ccccc1F
ETHYL4(2(((2FLUOROPHENYL)METHYL)((4METHYLPHENYL)SULFONYL)AMINO)ACETYL)PIPERAZINECARBOXYLATE
ETHYL4(2((2FLUOROPHENYL)METHYL(4METHYLPHENYL)SULFONYLAMINO)ACETYL)PIPERAZINE1CARBOXYLATE
ETHYL4(N(2FLUOROBENZYL)N((4METHYLPHENYL)SULFONYL)GLYCYL)PIPERAZINE1CARBOXYLATE
InChI=1SC23H28FN3O5Sc133223(29)26141225(131526)22(28)1727(1619645721(19)24)33(3031)2010818(2)91120h411H31217H212H3
MFCD03272279
STK030521
ZINC000000780793
ZINC00780793
ZINC780793

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Available files

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