3-(pyrimidin-2-ylamino)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 3-(pyrimidin-2-ylamino)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 3-(pyrimidin-2-ylamino)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 3-(2-pyrimidinylamino)-N-[[4-(1-pyrrolidinylmethyl)phenyl]methyl]benzamide IUPAC Name: 3-(pyrimidin-2-ylamino)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 3-(2-pyrimidylamino)-N-[4-(pyrrolidinomethyl)benzyl]benzamide Formula: C23H25N5O MolecularWeight: 387.4775

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(C=C2)CNC(=O)C3=CC(=CC=C3)NC4=NC=CC=N4

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)CNC(=O)C3=CC(=CC=C3)NC4=NC=CC=N4

InChI

InChI=1S/C23H25N5O/c29-22(20-5-3-6-21(15-20)27-23-24-11-4-12-25-23)26-16-18-7-9-19(10-8-18)17-28-13-1-2-14-28/h3-12,15H,1-2,13-14,16-17H2,(H,26,29)(H,24,25,27)