2-[4-azanylbutyl(3-phenylpropyl)amino]-6-pyridin-4-yl-1H-pyrimidin-4-one

Systemtic Name: 2-[4-azanylbutyl(3-phenylpropyl)amino]-6-pyridin-4-yl-1H-pyrimidin-4-one Openeye Name: 2-[4-aminobutyl(3-phenylpropyl)amino]-6-(4-pyridyl)-1H-pyrimidin-4-one CAS Name: 2-[4-aminobutyl(3-phenylpropyl)amino]-6-pyridin-4-yl-1H-pyrimidin-4-one IUPAC Name: 2-[4-aminobutyl(3-phenylpropyl)amino]-6-pyridin-4-yl-1H-pyrimidin-4-one Traditional Name: 2-[4-aminobutyl(3-phenylpropyl)amino]-6-(4-pyridyl)-1H-pyrimidin-4-one Formula: C22H27N5O MolecularWeight: 377.48268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCN(CCCCN)C2=NC(=O)C=C(N2)C3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCCN(CCCCN)C2=NC(=O)C=C(N2)C3=CC=NC=C3

InChI

InChI=1S/C22H27N5O/c23-12-4-5-15-27(16-6-9-18-7-2-1-3-8-18)22-25-20(17-21(28)26-22)19-10-13-24-14-11-19/h1-3,7-8,10-11,13-14,17H,4-6,9,12,15-16,23H2,(H,25,26,28)