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

Systemtic Name: N-[1-(3-methoxypropyl)-4,5-dimethyl-3-(phenylsulfonyl)pyrrol-2-yl]pyridine-4-carboxamide Openeye Name: N-[3-(benzenesulfonyl)-1-(3-methoxypropyl)-4,5-dimethyl-pyrrol-2-yl]pyridine-4-carboxamide CAS Name: N-[3-(benzenesulfonyl)-1-(3-methoxypropyl)-4,5-dimethyl-2-pyrrolyl]-4-pyridinecarboxamide IUPAC Name: N-[3-(benzenesulfonyl)-1-(3-methoxypropyl)-4,5-dimethylpyrrol-2-yl]pyridine-4-carboxamide Traditional Name: N-[3-besyl-1-(3-methoxypropyl)-4,5-dimethyl-pyrrol-2-yl]isonicotinamide Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1S(=O)(=O)C2=CC=CC=C2)NC(=O)C3=CC=NC=C3)CCCOC)C

Isomeric SMILES

CC1=C(N(C(=C1S(=O)(=O)C2=CC=CC=C2)NC(=O)C3=CC=NC=C3)CCCOC)C

InChI

InChI=1S/C22H25N3O4S/c1-16-17(2)25(14-7-15-29-3)21(24-22(26)18-10-12-23-13-11-18)20(16)30(27,28)19-8-5-4-6-9-19/h4-6,8-13H,7,14-15H2,1-3H3,(H,24,26)