2-[3-[3-(methylaminomethyl)phenoxy]propylamino]-5-[(6-methylpyridin-3-yl)methyl]-1H-pyrimidin-6-one

Systemtic Name: 2-[3-[3-(methylaminomethyl)phenoxy]propylamino]-5-[(6-methylpyridin-3-yl)methyl]-1H-pyrimidin-6-one Openeye Name: 2-[3-[3-(methylaminomethyl)phenoxy]propylamino]-5-[(6-methyl-3-pyridyl)methyl]-1H-pyrimidin-6-one CAS Name: 2-[3-[3-(methylaminomethyl)phenoxy]propylamino]-5-[(6-methyl-3-pyridinyl)methyl]-1H-pyrimidin-6-one IUPAC Name: 2-[3-[3-(methylaminomethyl)phenoxy]propylamino]-5-[(6-methylpyridin-3-yl)methyl]-1H-pyrimidin-6-one Traditional Name: 2-[3-[3-(methylaminomethyl)phenoxy]propylamino]-5-[(6-methyl-3-pyridyl)methyl]-1H-pyrimidin-6-one Formula: C22H27N5O2 MolecularWeight: 393.48208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)CC2=CN=C(NC2=O)NCCCOC3=CC=CC(=C3)CNC

Isomeric SMILES

CC1=NC=C(C=C1)CC2=CN=C(NC2=O)NCCCOC3=CC=CC(=C3)CNC

InChI

InChI=1S/C22H27N5O2/c1-16-7-8-18(14-25-16)11-19-15-26-22(27-21(19)28)24-9-4-10-29-20-6-3-5-17(12-20)13-23-2/h3,5-8,12,14-15,23H,4,9-11,13H2,1-2H3,(H2,24,26,27,28)