2-[4-[[methyl(pyrazin-2-ylmethyl)amino]methyl]phenyl]-6-(oxan-4-yl)-1H-pyrimidin-4-one

Systemtic Name: 2-[4-[[methyl(pyrazin-2-ylmethyl)amino]methyl]phenyl]-6-(oxan-4-yl)-1H-pyrimidin-4-one Openeye Name: 2-[4-[[methyl(pyrazin-2-ylmethyl)amino]methyl]phenyl]-6-tetrahydropyran-4-yl-1H-pyrimidin-4-one CAS Name: 2-[4-[[methyl(2-pyrazinylmethyl)amino]methyl]phenyl]-6-(4-oxanyl)-1H-pyrimidin-4-one IUPAC Name: 2-[4-[[methyl(pyrazin-2-ylmethyl)amino]methyl]phenyl]-6-(oxan-4-yl)-1H-pyrimidin-4-one Traditional Name: 2-[4-[[methyl(pyrazin-2-ylmethyl)amino]methyl]phenyl]-6-tetrahydropyran-4-yl-1H-pyrimidin-4-one Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C2=NC(=O)C=C(N2)C3CCOCC3)CC4=NC=CN=C4

Isomeric SMILES

CN(CC1=CC=C(C=C1)C2=NC(=O)C=C(N2)C3CCOCC3)CC4=NC=CN=C4

InChI

InChI=1S/C22H25N5O2/c1-27(15-19-13-23-8-9-24-19)14-16-2-4-18(5-3-16)22-25-20(12-21(28)26-22)17-6-10-29-11-7-17/h2-5,8-9,12-13,17H,6-7,10-11,14-15H2,1H3,(H,25,26,28)