2-[(2-chloranyl-5-fluoranyl-phenoxy)methyl]-3-methyl-6-piperazin-1-yl-pyrimidin-4-one

Systemtic Name: 2-[(2-chloranyl-5-fluoranyl-phenoxy)methyl]-3-methyl-6-piperazin-1-yl-pyrimidin-4-one Openeye Name: 2-[(2-chloro-5-fluoro-phenoxy)methyl]-3-methyl-6-piperazin-1-yl-pyrimidin-4-one CAS Name: 2-[(2-chloro-5-fluorophenoxy)methyl]-3-methyl-6-(1-piperazinyl)-4-pyrimidinone IUPAC Name: 2-[(2-chloro-5-fluorophenoxy)methyl]-3-methyl-6-piperazin-1-ylpyrimidin-4-one Traditional Name: 2-[(2-chloro-5-fluoro-phenoxy)methyl]-3-methyl-6-piperazino-pyrimidin-4-one Formula: C16H18ClFN4O2 MolecularWeight: 352.791123

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(N=C1COC2=C(C=CC(=C2)F)Cl)N3CCNCC3

Isomeric SMILES

CN1C(=O)C=C(N=C1COC2=C(C=CC(=C2)F)Cl)N3CCNCC3

InChI

InChI=1S/C16H18ClFN4O2/c1-21-15(10-24-13-8-11(18)2-3-12(13)17)20-14(9-16(21)23)22-6-4-19-5-7-22/h2-3,8-9,19H,4-7,10H2,1H3