4-[[4-[(2-chloranyl-5-fluoranyl-phenyl)methyl]piperidin-1-yl]methyl]-1-phenyl-1,3-diazinan-2-one

Systemtic Name: 4-[[4-[(2-chloranyl-5-fluoranyl-phenyl)methyl]piperidin-1-yl]methyl]-1-phenyl-1,3-diazinan-2-one Openeye Name: 4-[[4-[(2-chloro-5-fluoro-phenyl)methyl]-1-piperidyl]methyl]-1-phenyl-hexahydropyrimidin-2-one CAS Name: 4-[[4-[(2-chloro-5-fluorophenyl)methyl]-1-piperidinyl]methyl]-1-phenyl-1,3-diazinan-2-one IUPAC Name: 4-[[4-[(2-chloro-5-fluorophenyl)methyl]piperidin-1-yl]methyl]-1-phenyl-1,3-diazinan-2-one Traditional Name: 4-[[4-(2-chloro-5-fluoro-benzyl)piperidino]methyl]-1-phenyl-hexahydropyrimidin-2-one Formula: C23H27ClFN3O MolecularWeight: 415.931383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=C(C=CC(=C2)F)Cl)CC3CCN(C(=O)N3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1CC2=C(C=CC(=C2)F)Cl)CC3CCN(C(=O)N3)C4=CC=CC=C4

InChI

InChI=1S/C23H27ClFN3O/c24-22-7-6-19(25)15-18(22)14-17-8-11-27(12-9-17)16-20-10-13-28(23(29)26-20)21-4-2-1-3-5-21/h1-7,15,17,20H,8-14,16H2,(H,26,29)