N-[4-(3-methylphenyl)phenyl]-1-[(2-methylpyrimidin-5-yl)methyl]piperidine-4-carboxamide

Systemtic Name: N-[4-(3-methylphenyl)phenyl]-1-[(2-methylpyrimidin-5-yl)methyl]piperidine-4-carboxamide Openeye Name: 1-[(2-methylpyrimidin-5-yl)methyl]-N-[4-(m-tolyl)phenyl]piperidine-4-carboxamide CAS Name: N-[4-(3-methylphenyl)phenyl]-1-[(2-methyl-5-pyrimidinyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[4-(3-methylphenyl)phenyl]-1-[(2-methylpyrimidin-5-yl)methyl]piperidine-4-carboxamide Traditional Name: 1-[(2-methylpyrimidin-5-yl)methyl]-N-[4-(m-tolyl)phenyl]isonipecotamide Formula: C25H28N4O MolecularWeight: 400.51602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CC=C(C=C2)NC(=O)C3CCN(CC3)CC4=CN=C(N=C4)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=CC=C(C=C2)NC(=O)C3CCN(CC3)CC4=CN=C(N=C4)C

InChI

InChI=1S/C25H28N4O/c1-18-4-3-5-23(14-18)21-6-8-24(9-7-21)28-25(30)22-10-12-29(13-11-22)17-20-15-26-19(2)27-16-20/h3-9,14-16,22H,10-13,17H2,1-2H3,(H,28,30)