N-[1-butyl-4,5-dimethyl-3-(4-methylphenyl)sulfonyl-pyrrol-2-yl]propanamide

Systemtic Name: N-[1-butyl-4,5-dimethyl-3-(4-methylphenyl)sulfonyl-pyrrol-2-yl]propanamide Openeye Name: N-[1-butyl-4,5-dimethyl-3-(p-tolylsulfonyl)pyrrol-2-yl]propanamide CAS Name: N-[1-butyl-4,5-dimethyl-3-(4-methylphenyl)sulfonyl-2-pyrrolyl]propanamide IUPAC Name: N-[1-butyl-4,5-dimethyl-3-(4-methylphenyl)sulfonylpyrrol-2-yl]propanamide Traditional Name: N-(1-butyl-4,5-dimethyl-3-tosyl-pyrrol-2-yl)propionamide Formula: C20H28N2O3S MolecularWeight: 376.51292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N2O3S/c1-6-8-13-22-16(5)15(4)19(20(22)21-18(23)7-2)26(24,25)17-11-9-14(3)10-12-17/h9-12H,6-8,13H2,1-5H3,(H,21,23)