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

Systemtic Name: N-[1-butyl-3-(4-methoxyphenyl)sulfonyl-4,5-dimethyl-pyrrol-2-yl]pyridine-4-carboxamide Openeye Name: N-[1-butyl-3-(4-methoxyphenyl)sulfonyl-4,5-dimethyl-pyrrol-2-yl]pyridine-4-carboxamide CAS Name: N-[1-butyl-3-(4-methoxyphenyl)sulfonyl-4,5-dimethyl-2-pyrrolyl]-4-pyridinecarboxamide IUPAC Name: N-[1-butyl-3-(4-methoxyphenyl)sulfonyl-4,5-dimethylpyrrol-2-yl]pyridine-4-carboxamide Traditional Name: N-[1-butyl-3-(4-methoxyphenyl)sulfonyl-4,5-dimethyl-pyrrol-2-yl]isonicotinamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=C1NC(=O)C2=CC=NC=C2)S(=O)(=O)C3=CC=C(C=C3)OC)C)C

Isomeric SMILES

CCCCN1C(=C(C(=C1NC(=O)C2=CC=NC=C2)S(=O)(=O)C3=CC=C(C=C3)OC)C)C

InChI

InChI=1S/C23H27N3O4S/c1-5-6-15-26-17(3)16(2)21(22(26)25-23(27)18-11-13-24-14-12-18)31(28,29)20-9-7-19(30-4)8-10-20/h7-14H,5-6,15H2,1-4H3,(H,25,27)