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

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-1-(4-phenylazanylpyrimidin-2-yl)piperidine-4-carboxamide Openeye Name: 1-(4-anilinopyrimidin-2-yl)-N-[(4-dimethylaminophenyl)methyl]piperidine-4-carboxamide CAS Name: 1-(4-anilino-2-pyrimidinyl)-N-[(4-dimethylaminophenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-anilinopyrimidin-2-yl)-N-[(4-dimethylaminophenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(4-anilinopyrimidin-2-yl)-N-[4-(dimethylamino)benzyl]isonipecotamide Formula: C25H30N6O MolecularWeight: 430.5453

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC(=O)C2CCN(CC2)C3=NC=CC(=N3)NC4=CC=CC=C4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC(=O)C2CCN(CC2)C3=NC=CC(=N3)NC4=CC=CC=C4

InChI

InChI=1S/C25H30N6O/c1-30(2)22-10-8-19(9-11-22)18-27-24(32)20-13-16-31(17-14-20)25-26-15-12-23(29-25)28-21-6-4-3-5-7-21/h3-12,15,20H,13-14,16-18H2,1-2H3,(H,27,32)(H,26,28,29)