2-[(2S)-2,4-dimethylpiperazin-1-yl]-6-(3-fluoranylpyridin-4-yl)-3-methyl-pyrimidin-4-one

Systemtic Name: 2-[(2S)-2,4-dimethylpiperazin-1-yl]-6-(3-fluoranylpyridin-4-yl)-3-methyl-pyrimidin-4-one Openeye Name: 2-[(2S)-2,4-dimethylpiperazin-1-yl]-6-(3-fluoro-4-pyridyl)-3-methyl-pyrimidin-4-one CAS Name: 2-[(2S)-2,4-dimethyl-1-piperazinyl]-6-(3-fluoro-4-pyridinyl)-3-methyl-4-pyrimidinone IUPAC Name: 2-[(2S)-2,4-dimethylpiperazin-1-yl]-6-(3-fluoropyridin-4-yl)-3-methylpyrimidin-4-one Traditional Name: 2-[(2S)-2,4-dimethylpiperazino]-6-(3-fluoro-4-pyridyl)-3-methyl-pyrimidin-4-one Formula: C16H20FN5O MolecularWeight: 317.361303

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=NC(=CC(=O)N2C)C3=C(C=NC=C3)F)C

Isomeric SMILES

C[C@H]1CN(CCN1C2=NC(=CC(=O)N2C)C3=C(C=NC=C3)F)C

InChI

InChI=1S/C16H20FN5O/c1-11-10-20(2)6-7-22(11)16-19-14(8-15(23)21(16)3)12-4-5-18-9-13(12)17/h4-5,8-9,11H,6-7,10H2,1-3H3/t11-/m0/s1