2-[2-[[methyl(2-pyrazol-1-ylethyl)amino]methyl]phenyl]-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-[[methyl(2-pyrazol-1-ylethyl)amino]methyl]phenyl]-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[2-[[methyl(2-pyrazol-1-ylethyl)amino]methyl]phenyl]-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[2-[[methyl-[2-(1-pyrazolyl)ethyl]amino]methyl]phenyl]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-[[methyl(2-pyrazol-1-ylethyl)amino]methyl]phenyl]-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[2-[[methyl(2-pyrazol-1-ylethyl)amino]methyl]phenyl]-6-propyl-1H-pyrimidin-4-one Formula: C20H25N5O MolecularWeight: 351.4454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)C2=CC=CC=C2CN(C)CCN3C=CC=N3

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)C2=CC=CC=C2CN(C)CCN3C=CC=N3

InChI

InChI=1S/C20H25N5O/c1-3-7-17-14-19(26)23-20(22-17)18-9-5-4-8-16(18)15-24(2)12-13-25-11-6-10-21-25/h4-6,8-11,14H,3,7,12-13,15H2,1-2H3,(H,22,23,26)