N-(3-chloranyl-2-methyl-phenyl)-1-(5-pyrrol-1-ylpyridin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-1-(5-pyrrol-1-ylpyridin-2-yl)piperidine-4-carboxamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-1-(5-pyrrol-1-yl-2-pyridyl)piperidine-4-carboxamide CAS Name: N-(3-chloro-2-methylphenyl)-1-[5-(1-pyrrolyl)-2-pyridinyl]-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-2-methylphenyl)-1-(5-pyrrol-1-ylpyridin-2-yl)piperidine-4-carboxamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-1-(5-pyrrol-1-yl-2-pyridyl)isonipecotamide Formula: C22H23ClN4O MolecularWeight: 394.89722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C2CCN(CC2)C3=NC=C(C=C3)N4C=CC=C4

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C2CCN(CC2)C3=NC=C(C=C3)N4C=CC=C4

InChI

InChI=1S/C22H23ClN4O/c1-16-19(23)5-4-6-20(16)25-22(28)17-9-13-27(14-10-17)21-8-7-18(15-24-21)26-11-2-3-12-26/h2-8,11-12,15,17H,9-10,13-14H2,1H3,(H,25,28)