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

Systemtic Name: 2-[3-[[furan-3-ylmethyl(methyl)amino]methyl]phenyl]-6-piperidin-4-yl-1H-pyrimidin-4-one Openeye Name: 2-[3-[[3-furylmethyl(methyl)amino]methyl]phenyl]-6-(4-piperidyl)-1H-pyrimidin-4-one CAS Name: 2-[3-[[3-furanylmethyl(methyl)amino]methyl]phenyl]-6-(4-piperidinyl)-1H-pyrimidin-4-one IUPAC Name: 2-[3-[[furan-3-ylmethyl(methyl)amino]methyl]phenyl]-6-piperidin-4-yl-1H-pyrimidin-4-one Traditional Name: 2-[3-[[3-furfuryl(methyl)amino]methyl]phenyl]-6-(4-piperidyl)-1H-pyrimidin-4-one Formula: C22H26N4O2 MolecularWeight: 378.46744

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=COC=C1)CC2=CC=CC(=C2)C3=NC(=O)C=C(N3)C4CCNCC4

Isomeric SMILES

CN(CC1=COC=C1)CC2=CC=CC(=C2)C3=NC(=O)C=C(N3)C4CCNCC4

InChI

InChI=1S/C22H26N4O2/c1-26(14-17-7-10-28-15-17)13-16-3-2-4-19(11-16)22-24-20(12-21(27)25-22)18-5-8-23-9-6-18/h2-4,7,10-12,15,18,23H,5-6,8-9,13-14H2,1H3,(H,24,25,27)