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

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-1-(5-pyrrol-1-ylpyridin-2-yl)piperidine-4-carboxamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-1-(5-pyrrol-1-yl-2-pyridyl)piperidine-4-carboxamide CAS Name: N-(3-chloro-4-methylphenyl)-1-[5-(1-pyrrolyl)-2-pyridinyl]-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-4-methylphenyl)-1-(5-pyrrol-1-ylpyridin-2-yl)piperidine-4-carboxamide Traditional Name: N-(3-chloro-4-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=C(C=C1)NC(=O)C2CCN(CC2)C3=NC=C(C=C3)N4C=CC=C4)Cl

Isomeric SMILES

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

InChI

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