N-[4,5-dimethyl-3-(4-methylphenyl)sulfonyl-1-propyl-pyrrol-2-yl]pyridine-4-carboxamide

Systemtic Name: N-[4,5-dimethyl-3-(4-methylphenyl)sulfonyl-1-propyl-pyrrol-2-yl]pyridine-4-carboxamide Openeye Name: N-[4,5-dimethyl-1-propyl-3-(p-tolylsulfonyl)pyrrol-2-yl]pyridine-4-carboxamide CAS Name: N-[4,5-dimethyl-3-(4-methylphenyl)sulfonyl-1-propyl-2-pyrrolyl]-4-pyridinecarboxamide IUPAC Name: N-[4,5-dimethyl-3-(4-methylphenyl)sulfonyl-1-propylpyrrol-2-yl]pyridine-4-carboxamide Traditional Name: N-(4,5-dimethyl-1-propyl-3-tosyl-pyrrol-2-yl)isonicotinamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=C1NC(=O)C2=CC=NC=C2)S(=O)(=O)C3=CC=C(C=C3)C)C)C

Isomeric SMILES

CCCN1C(=C(C(=C1NC(=O)C2=CC=NC=C2)S(=O)(=O)C3=CC=C(C=C3)C)C)C

InChI

InChI=1S/C22H25N3O3S/c1-5-14-25-17(4)16(3)20(29(27,28)19-8-6-15(2)7-9-19)21(25)24-22(26)18-10-12-23-13-11-18/h6-13H,5,14H2,1-4H3,(H,24,26)