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

Systemtic Name: N-[1-butyl-4,5-dimethyl-3-(phenylsulfonyl)pyrrol-2-yl]butanamide Openeye Name: N-[3-(benzenesulfonyl)-1-butyl-4,5-dimethyl-pyrrol-2-yl]butanamide CAS Name: N-[3-(benzenesulfonyl)-1-butyl-4,5-dimethyl-2-pyrrolyl]butanamide IUPAC Name: N-[3-(benzenesulfonyl)-1-butyl-4,5-dimethylpyrrol-2-yl]butanamide Traditional Name: N-(3-besyl-1-butyl-4,5-dimethyl-pyrrol-2-yl)butyramide Formula: C20H28N2O3S MolecularWeight: 376.51292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=C1NC(=O)CCC)S(=O)(=O)C2=CC=CC=C2)C)C

Isomeric SMILES

CCCCN1C(=C(C(=C1NC(=O)CCC)S(=O)(=O)C2=CC=CC=C2)C)C

InChI

InChI=1S/C20H28N2O3S/c1-5-7-14-22-16(4)15(3)19(20(22)21-18(23)11-6-2)26(24,25)17-12-9-8-10-13-17/h8-10,12-13H,5-7,11,14H2,1-4H3,(H,21,23)