N-[[1-[(2-azanylpyrimidin-5-yl)methyl]piperidin-3-yl]methyl]-3-phenyl-propanamide

Systemtic Name: N-[[1-[(2-azanylpyrimidin-5-yl)methyl]piperidin-3-yl]methyl]-3-phenyl-propanamide Openeye Name: N-[[1-[(2-aminopyrimidin-5-yl)methyl]-3-piperidyl]methyl]-3-phenyl-propanamide CAS Name: N-[[1-[(2-amino-5-pyrimidinyl)methyl]-3-piperidinyl]methyl]-3-phenylpropanamide IUPAC Name: N-[[1-[(2-aminopyrimidin-5-yl)methyl]piperidin-3-yl]methyl]-3-phenylpropanamide Traditional Name: N-[[1-[(2-aminopyrimidin-5-yl)methyl]-3-piperidyl]methyl]-3-phenyl-propionamide Formula: C20H27N5O MolecularWeight: 353.46128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CN=C(N=C2)N)CNC(=O)CCC3=CC=CC=C3

Isomeric SMILES

C1CC(CN(C1)CC2=CN=C(N=C2)N)CNC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C20H27N5O/c21-20-23-12-18(13-24-20)15-25-10-4-7-17(14-25)11-22-19(26)9-8-16-5-2-1-3-6-16/h1-3,5-6,12-13,17H,4,7-11,14-15H2,(H,22,26)(H2,21,23,24)