Vitas-M small molecule compound

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

Catalog ID
STK941568
SMILES CCCCn1c(C)c(c(c1NC(=O)C)S(=O)(=O)c1ccccc1)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 C18H24N2O3S MW 348.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N2O3S/c1-5-6-12-20-14(3)13(2)17(18(20)19-15(4)21)24(22,23)16-10-8-7-9-11-16/h7-11H,5-6,12H2,1-4H3,(H,19,21)
InChIKey
SVRBJKYSWPTWCI-UHFFFAOYSA-N
Synonyms
951961-14-1
951961141
CCCCN1C(=C(C(=C1NC(=O)C)S(=O)(=O)C2=CC=CC=C2)C)C
InChI=1SC18H24N2O3Sc156122014(3)13(2)17(18(20)1915(4)21)24(2223)16108791116h711H5612H214H3(H1921)
MFCD09857985
N(1butyl45dimethyl3(phenylsulfonyl)1Hpyrrol2yl)acetamide
N(3(benzenesulfonyl)1butyl45dimethylpyrrol2yl)acetamide
ZINC000013732331
ZINC13732331

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Available files

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