Vitas-M small molecule compound

ethyl 4-[N-(3-methylphenyl)-N-(phenylsulfonyl)glycyl]piperazine-1-carboxylate

Catalog ID
STK326659
SMILES CCOC(=O)N1CCN(CC1)C(=O)CN(S(=O)(=O)c1ccccc1)c1cccc(c1)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 C22H27N3O5S MW 445.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O5S/c1-3-30-22(27)24-14-12-23(13-15-24)21(26)17-25(19-9-7-8-18(2)16-19)31(28,29)20-10-5-4-6-11-20/h4-11,16H,3,12-15,17H2,1-2H3
InChIKey
AEVCSQFPOCZQMM-UHFFFAOYSA-N
Synonyms

4(2(BENZENESULFONYLMTOLYLAMINO)ACETYL)PIPERAZINE1CARBOXYLICACIDETHYL
CCOC(=O)N1CCN(CC1)C(=O)CN(C2=CC=CC(=C2)C)S(=O)(=O)C3=CC=CC=C3
ethyl4(2(N(benzenesulfonyl)3methylanilino)acetyl)piperazine1carboxylate
ETHYL4(N(3METHYLPHENYL)N(PHENYLSULFONYL)GLYCYL)PIPERAZINE1CARBOXYLATE
InChI=1SC22H27N3O5Sc133022(27)24141223(131524)21(26)1725(1997818(2)1619)31(2829)20105461120h41116H3121517H212H3
MFCD03119377
ZINC000000886911
ZINC00886911
ZINC886911

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Available files

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