Vitas-M small molecule compound

N-[1-benzyl-4,5-dimethyl-3-(phenylsulfonyl)-1H-pyrrol-2-yl]butanamide

Catalog ID
STK719600
SMILES CCCC(=O)Nc1n(Cc2ccccc2)c(c(c1S(=O)(=O)c1ccccc1)C)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 C23H26N2O3S MW 410.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2O3S/c1-4-11-21(26)24-23-22(29(27,28)20-14-9-6-10-15-20)17(2)18(3)25(23)16-19-12-7-5-8-13-19/h5-10,12-15H,4,11,16H2,1-3H3,(H,24,26)
InChIKey
ZWWQEIRWSGRYQS-UHFFFAOYSA-N
Synonyms
1010879-42-1
1010879421
CCCC(=O)NC1=C(C(=C(N1CC2=CC=CC=C2)C)C)S(=O)(=O)C3=CC=CC=C3
InChI=1SC23H26N2O3Sc141121(26)242322(29(2728)201496101520)17(2)18(3)25(23)1619127581319h5101215H41116H213H3(H2426)
MFCD12201283
N(1benzyl45dimethyl3(phenylsulfonyl)1Hpyrrol2yl)butanamide
N(1benzyl45dimethyl3(phenylsulfonyl)1Hpyrrol2yl)butyramide
N(3(benzenesulfonyl)1benzyl45dimethylpyrrol2yl)butanamide
ZINC000012389577
ZINC12389577

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Available files

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