N-[(3-chlorophenyl)methyl]-1-(4-phenylazanylpyrimidin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-1-(4-phenylazanylpyrimidin-2-yl)piperidine-4-carboxamide Openeye Name: 1-(4-anilinopyrimidin-2-yl)-N-[(3-chlorophenyl)methyl]piperidine-4-carboxamide CAS Name: 1-(4-anilino-2-pyrimidinyl)-N-[(3-chlorophenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-anilinopyrimidin-2-yl)-N-[(3-chlorophenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(4-anilinopyrimidin-2-yl)-N-(3-chlorobenzyl)isonipecotamide Formula: C23H24ClN5O MolecularWeight: 421.92256

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC(=CC=C2)Cl)C3=NC=CC(=N3)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC(=CC=C2)Cl)C3=NC=CC(=N3)NC4=CC=CC=C4

InChI

InChI=1S/C23H24ClN5O/c24-19-6-4-5-17(15-19)16-26-22(30)18-10-13-29(14-11-18)23-25-12-9-21(28-23)27-20-7-2-1-3-8-20/h1-9,12,15,18H,10-11,13-14,16H2,(H,26,30)(H,25,27,28)