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

Systemtic Name: 2-[4-[[furan-3-ylmethyl(methyl)amino]methyl]phenyl]-6-piperidin-4-yl-1H-pyrimidin-4-one Openeye Name: 2-[4-[[3-furylmethyl(methyl)amino]methyl]phenyl]-6-(4-piperidyl)-1H-pyrimidin-4-one CAS Name: 2-[4-[[3-furanylmethyl(methyl)amino]methyl]phenyl]-6-(4-piperidinyl)-1H-pyrimidin-4-one IUPAC Name: 2-[4-[[furan-3-ylmethyl(methyl)amino]methyl]phenyl]-6-piperidin-4-yl-1H-pyrimidin-4-one Traditional Name: 2-[4-[[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=CC=C(C=C1)C2=NC(=O)C=C(N2)C3CCNCC3)CC4=COC=C4

Isomeric SMILES

CN(CC1=CC=C(C=C1)C2=NC(=O)C=C(N2)C3CCNCC3)CC4=COC=C4

InChI

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