Vitas-M small molecule compound

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

Catalog ID
STK645519
SMILES COCCCn1c(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 C18H24N2O4S MW 364.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N2O4S/c1-13-14(2)20(11-8-12-24-4)18(19-15(3)21)17(13)25(22,23)16-9-6-5-7-10-16/h5-7,9-10H,8,11-12H2,1-4H3,(H,19,21)
InChIKey
DJBHYPFDQOTDOB-UHFFFAOYSA-N
Synonyms
1010878-47-3
1010878473
CC1=C(N(C(=C1S(=O)(=O)C2=CC=CC=C2)NC(=O)C)CCCOC)C
InChI=1SC18H24N2O4Sc11314(2)20(11812244)18(1915(3)21)17(13)25(2223)1696571016h57910H81112H214H3(H1921)
MFCD12199037
N(1(3methoxypropyl)45dimethyl3(phenylsulfonyl)1Hpyrrol2yl)acetamide
N(3(benzenesulfonyl)1(3methoxypropyl)45dimethylpyrrol2yl)acetamide
ZINC000012321124
ZINC12321124

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Available files

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