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

Systemtic Name: 6-(furan-3-yl)-2-[3-[[methyl(2-pyrazol-1-ylethyl)amino]methyl]phenyl]-1H-pyrimidin-4-one Openeye Name: 6-(3-furyl)-2-[3-[[methyl(2-pyrazol-1-ylethyl)amino]methyl]phenyl]-1H-pyrimidin-4-one CAS Name: 6-(3-furanyl)-2-[3-[[methyl-[2-(1-pyrazolyl)ethyl]amino]methyl]phenyl]-1H-pyrimidin-4-one IUPAC Name: 6-(furan-3-yl)-2-[3-[[methyl(2-pyrazol-1-ylethyl)amino]methyl]phenyl]-1H-pyrimidin-4-one Traditional Name: 6-(3-furyl)-2-[3-[[methyl(2-pyrazol-1-ylethyl)amino]methyl]phenyl]-1H-pyrimidin-4-one Formula: C21H21N5O2 MolecularWeight: 375.42374

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCN1C=CC=N1)CC2=CC=CC(=C2)C3=NC(=O)C=C(N3)C4=COC=C4

Isomeric SMILES

CN(CCN1C=CC=N1)CC2=CC=CC(=C2)C3=NC(=O)C=C(N3)C4=COC=C4

InChI

InChI=1S/C21H21N5O2/c1-25(9-10-26-8-3-7-22-26)14-16-4-2-5-17(12-16)21-23-19(13-20(27)24-21)18-6-11-28-15-18/h2-8,11-13,15H,9-10,14H2,1H3,(H,23,24,27)