5-fluoranyl-6-methyl-2-[3-[[prop-2-enyl(pyridin-3-ylmethyl)amino]methyl]phenyl]-1H-pyrimidin-4-one

Systemtic Name: 5-fluoranyl-6-methyl-2-[3-[[prop-2-enyl(pyridin-3-ylmethyl)amino]methyl]phenyl]-1H-pyrimidin-4-one Openeye Name: 2-[3-[[allyl(3-pyridylmethyl)amino]methyl]phenyl]-5-fluoro-6-methyl-1H-pyrimidin-4-one CAS Name: 5-fluoro-6-methyl-2-[3-[[prop-2-enyl(3-pyridinylmethyl)amino]methyl]phenyl]-1H-pyrimidin-4-one IUPAC Name: 5-fluoro-6-methyl-2-[3-[[prop-2-enyl(pyridin-3-ylmethyl)amino]methyl]phenyl]-1H-pyrimidin-4-one Traditional Name: 2-[3-[[allyl(3-pyridylmethyl)amino]methyl]phenyl]-5-fluoro-6-methyl-1H-pyrimidin-4-one Formula: C21H21FN4O MolecularWeight: 364.416043

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21FN4O/c1-3-10-26(14-17-7-5-9-23-12-17)13-16-6-4-8-18(11-16)20-24-15(2)19(22)21(27)25-20/h3-9,11-12H,1,10,13-14H2,2H3,(H,24,25,27)