Vitas-M small molecule compound

1-butyl-4,5-dimethyl-3-(phenylsulfonyl)-1H-pyrrol-2-amine

Catalog ID
STK646585
SMILES CCCCn1c(C)c(c(c1N)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 C16H22N2O2S MW 306.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2O2S/c1-4-5-11-18-13(3)12(2)15(16(18)17)21(19,20)14-9-7-6-8-10-14/h6-10H,4-5,11,17H2,1-3H3
InChIKey
QHBIRPJCNKCFGS-UHFFFAOYSA-N
Synonyms
77444-93-0
1butyl45dimethyl3(phenylsulfonyl)1Hpyrrol2amine
3(BENZENESULFONYL)1BUTYL45DIMETHYLPYRROL2AMINE
CCCCN1C(=C(C(=C1N)S(=O)(=O)C2=CC=CC=C2)C)C
Registry IDs
MFCD00103626
ZINC000002148052
ZINC02148052
ZINC2148052

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Available files

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