2-[4-[[(3S)-3-(dimethylamino)piperidin-1-yl]methyl]phenyl]-5-fluoranyl-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[4-[[(3S)-3-(dimethylamino)piperidin-1-yl]methyl]phenyl]-5-fluoranyl-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[4-[[(3S)-3-(dimethylamino)-1-piperidyl]methyl]phenyl]-5-fluoro-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[4-[[(3S)-3-(dimethylamino)-1-piperidinyl]methyl]phenyl]-5-fluoro-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[4-[[(3S)-3-(dimethylamino)piperidin-1-yl]methyl]phenyl]-5-fluoro-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[4-[[(3S)-3-(dimethylamino)piperidino]methyl]phenyl]-5-fluoro-6-methyl-1H-pyrimidin-4-one Formula: C19H25FN4O MolecularWeight: 344.426403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)C2=CC=C(C=C2)CN3CCCC(C3)N(C)C)F

Isomeric SMILES

CC1=C(C(=O)N=C(N1)C2=CC=C(C=C2)CN3CCC[C@@H](C3)N(C)C)F

InChI

InChI=1S/C19H25FN4O/c1-13-17(20)19(25)22-18(21-13)15-8-6-14(7-9-15)11-24-10-4-5-16(12-24)23(2)3/h6-9,16H,4-5,10-12H2,1-3H3,(H,21,22,25)/t16-/m0/s1