5-[(6-methylpyridin-3-yl)methyl]-2-(4-phenylbutylamino)-1H-pyrimidin-6-one

Systemtic Name: 5-[(6-methylpyridin-3-yl)methyl]-2-(4-phenylbutylamino)-1H-pyrimidin-6-one Openeye Name: 5-[(6-methyl-3-pyridyl)methyl]-2-(4-phenylbutylamino)-1H-pyrimidin-6-one CAS Name: 5-[(6-methyl-3-pyridinyl)methyl]-2-(4-phenylbutylamino)-1H-pyrimidin-6-one IUPAC Name: 5-[(6-methylpyridin-3-yl)methyl]-2-(4-phenylbutylamino)-1H-pyrimidin-6-one Traditional Name: 5-[(6-methyl-3-pyridyl)methyl]-2-(4-phenylbutylamino)-1H-pyrimidin-6-one Formula: C21H24N4O MolecularWeight: 348.44146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)CC2=CN=C(NC2=O)NCCCCC3=CC=CC=C3

Isomeric SMILES

CC1=NC=C(C=C1)CC2=CN=C(NC2=O)NCCCCC3=CC=CC=C3

InChI

InChI=1S/C21H24N4O/c1-16-10-11-18(14-23-16)13-19-15-24-21(25-20(19)26)22-12-6-5-9-17-7-3-2-4-8-17/h2-4,7-8,10-11,14-15H,5-6,9,12-13H2,1H3,(H2,22,24,25,26)