N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]-3-(pyrimidin-2-ylamino)benzamide

Systemtic Name: N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]-3-(pyrimidin-2-ylamino)benzamide Openeye Name: N-[[2-(1-piperidylmethyl)phenyl]methyl]-3-(pyrimidin-2-ylamino)benzamide CAS Name: N-[[2-(1-piperidinylmethyl)phenyl]methyl]-3-(2-pyrimidinylamino)benzamide IUPAC Name: N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]-3-(pyrimidin-2-ylamino)benzamide Traditional Name: N-[2-(piperidinomethyl)benzyl]-3-(2-pyrimidylamino)benzamide Formula: C24H27N5O MolecularWeight: 401.50408

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=CC=C2CNC(=O)C3=CC(=CC=C3)NC4=NC=CC=N4

Isomeric SMILES

C1CCN(CC1)CC2=CC=CC=C2CNC(=O)C3=CC(=CC=C3)NC4=NC=CC=N4

InChI

InChI=1S/C24H27N5O/c30-23(19-10-6-11-22(16-19)28-24-25-12-7-13-26-24)27-17-20-8-2-3-9-21(20)18-29-14-4-1-5-15-29/h2-3,6-13,16H,1,4-5,14-15,17-18H2,(H,27,30)(H,25,26,28)