2-[4-(3-methoxypyridin-2-yl)butylamino]-5-[oxidanyl(pyridin-4-yl)methyl]-1H-pyrimidin-6-one

Systemtic Name: 2-[4-(3-methoxypyridin-2-yl)butylamino]-5-[oxidanyl(pyridin-4-yl)methyl]-1H-pyrimidin-6-one Openeye Name: 5-[hydroxy(4-pyridyl)methyl]-2-[4-(3-methoxy-2-pyridyl)butylamino]-1H-pyrimidin-6-one CAS Name: 5-[hydroxy(pyridin-4-yl)methyl]-2-[4-(3-methoxy-2-pyridinyl)butylamino]-1H-pyrimidin-6-one IUPAC Name: 5-[hydroxy(pyridin-4-yl)methyl]-2-[4-(3-methoxypyridin-2-yl)butylamino]-1H-pyrimidin-6-one Traditional Name: 5-[hydroxy(4-pyridyl)methyl]-2-[4-(3-methoxy-2-pyridyl)butylamino]-1H-pyrimidin-6-one Formula: C20H23N5O3 MolecularWeight: 381.42832

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(N=CC=C1)CCCCNC2=NC=C(C(=O)N2)C(C3=CC=NC=C3)O

Isomeric SMILES

COC1=C(N=CC=C1)CCCCNC2=NC=C(C(=O)N2)C(C3=CC=NC=C3)O

InChI

InChI=1S/C20H23N5O3/c1-28-17-6-4-10-22-16(17)5-2-3-9-23-20-24-13-15(19(27)25-20)18(26)14-7-11-21-12-8-14/h4,6-8,10-13,18,26H,2-3,5,9H2,1H3,(H2,23,24,25,27)