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

Systemtic Name: 2-[3-[[furan-3-ylmethyl(methyl)amino]methyl]phenyl]-6-(2-methylpropyl)-1H-pyrimidin-4-one Openeye Name: 2-[3-[[3-furylmethyl(methyl)amino]methyl]phenyl]-6-isobutyl-1H-pyrimidin-4-one CAS Name: 2-[3-[[3-furanylmethyl(methyl)amino]methyl]phenyl]-6-(2-methylpropyl)-1H-pyrimidin-4-one IUPAC Name: 2-[3-[[furan-3-ylmethyl(methyl)amino]methyl]phenyl]-6-(2-methylpropyl)-1H-pyrimidin-4-one Traditional Name: 2-[3-[[3-furfuryl(methyl)amino]methyl]phenyl]-6-isobutyl-1H-pyrimidin-4-one Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=O)N=C(N1)C2=CC(=CC=C2)CN(C)CC3=COC=C3

Isomeric SMILES

CC(C)CC1=CC(=O)N=C(N1)C2=CC(=CC=C2)CN(C)CC3=COC=C3

InChI

InChI=1S/C21H25N3O2/c1-15(2)9-19-11-20(25)23-21(22-19)18-6-4-5-16(10-18)12-24(3)13-17-7-8-26-14-17/h4-8,10-11,14-15H,9,12-13H2,1-3H3,(H,22,23,25)