2-[4-(1H-imidazol-5-yl)butylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one

Systemtic Name: 2-[4-(1H-imidazol-5-yl)butylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Openeye Name: 2-[4-(1H-imidazol-5-yl)butylamino]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one CAS Name: 2-[4-(1H-imidazol-5-yl)butylamino]-5-(3-pyridinylmethyl)-1H-pyrimidin-6-one IUPAC Name: 2-[4-(1H-imidazol-5-yl)butylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Traditional Name: 2-[4-(1H-imidazol-5-yl)butylamino]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one Formula: C17H20N6O MolecularWeight: 324.3803

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CC2=CN=C(NC2=O)NCCCCC3=CN=CN3

Isomeric SMILES

C1=CC(=CN=C1)CC2=CN=C(NC2=O)NCCCCC3=CN=CN3

InChI

InChI=1S/C17H20N6O/c24-16-14(8-13-4-3-6-18-9-13)10-21-17(23-16)20-7-2-1-5-15-11-19-12-22-15/h3-4,6,9-12H,1-2,5,7-8H2,(H,19,22)(H2,20,21,23,24)