N-(2,5-dimethylphenyl)-1-(3-pyrrol-1-ylpyridin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-(2,5-dimethylphenyl)-1-(3-pyrrol-1-ylpyridin-2-yl)piperidine-4-carboxamide Openeye Name: N-(2,5-dimethylphenyl)-1-(3-pyrrol-1-yl-2-pyridyl)piperidine-4-carboxamide CAS Name: N-(2,5-dimethylphenyl)-1-[3-(1-pyrrolyl)-2-pyridinyl]-4-piperidinecarboxamide IUPAC Name: N-(2,5-dimethylphenyl)-1-(3-pyrrol-1-ylpyridin-2-yl)piperidine-4-carboxamide Traditional Name: N-(2,5-dimethylphenyl)-1-(3-pyrrol-1-yl-2-pyridyl)isonipecotamide Formula: C23H26N4O MolecularWeight: 374.47874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C2CCN(CC2)C3=C(C=CC=N3)N4C=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C2CCN(CC2)C3=C(C=CC=N3)N4C=CC=C4

InChI

InChI=1S/C23H26N4O/c1-17-7-8-18(2)20(16-17)25-23(28)19-9-14-27(15-10-19)22-21(6-5-11-24-22)26-12-3-4-13-26/h3-8,11-13,16,19H,9-10,14-15H2,1-2H3,(H,25,28)