3-(4-azanylbutyl)-2-(3-phenylpropylamino)-6-pyridin-4-yl-pyrimidin-4-one

Systemtic Name: 3-(4-azanylbutyl)-2-(3-phenylpropylamino)-6-pyridin-4-yl-pyrimidin-4-one Openeye Name: 3-(4-aminobutyl)-2-(3-phenylpropylamino)-6-(4-pyridyl)pyrimidin-4-one CAS Name: 3-(4-aminobutyl)-2-(3-phenylpropylamino)-6-pyridin-4-yl-4-pyrimidinone IUPAC Name: 3-(4-aminobutyl)-2-(3-phenylpropylamino)-6-pyridin-4-ylpyrimidin-4-one Traditional Name: 3-(4-aminobutyl)-2-(3-phenylpropylamino)-6-(4-pyridyl)pyrimidin-4-one Formula: C22H27N5O MolecularWeight: 377.48268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC2=NC(=CC(=O)N2CCCCN)C3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCCNC2=NC(=CC(=O)N2CCCCN)C3=CC=NC=C3

InChI

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