2-[3-[[furan-3-ylmethyl(methyl)amino]methyl]phenyl]-6-(oxan-4-yl)-1H-pyrimidin-4-one

Systemtic Name: 2-[3-[[furan-3-ylmethyl(methyl)amino]methyl]phenyl]-6-(oxan-4-yl)-1H-pyrimidin-4-one Openeye Name: 2-[3-[[3-furylmethyl(methyl)amino]methyl]phenyl]-6-tetrahydropyran-4-yl-1H-pyrimidin-4-one CAS Name: 2-[3-[[3-furanylmethyl(methyl)amino]methyl]phenyl]-6-(4-oxanyl)-1H-pyrimidin-4-one IUPAC Name: 2-[3-[[furan-3-ylmethyl(methyl)amino]methyl]phenyl]-6-(oxan-4-yl)-1H-pyrimidin-4-one Traditional Name: 2-[3-[[3-furfuryl(methyl)amino]methyl]phenyl]-6-tetrahydropyran-4-yl-1H-pyrimidin-4-one Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=COC=C1)CC2=CC=CC(=C2)C3=NC(=O)C=C(N3)C4CCOCC4

Isomeric SMILES

CN(CC1=COC=C1)CC2=CC=CC(=C2)C3=NC(=O)C=C(N3)C4CCOCC4

InChI

InChI=1S/C22H25N3O3/c1-25(14-17-5-8-28-15-17)13-16-3-2-4-19(11-16)22-23-20(12-21(26)24-22)18-6-9-27-10-7-18/h2-5,8,11-12,15,18H,6-7,9-10,13-14H2,1H3,(H,23,24,26)