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

Systemtic Name: 1-[4-[5-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-6-methyl-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]propan-1-one Openeye Name: 1-[4-[5-[(2-chloro-6-fluoro-phenyl)methyl]-6-methyl-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]propan-1-one CAS Name: 1-[4-[5-[(2-chloro-6-fluorophenyl)methyl]-6-methyl-2-phenyl-4-pyrimidinyl]-1-piperazinyl]-1-propanone IUPAC Name: 1-[4-[5-[(2-chloro-6-fluorophenyl)methyl]-6-methyl-2-phenylpyrimidin-4-yl]piperazin-1-yl]propan-1-one Traditional Name: 1-[4-[5-(2-chloro-6-fluoro-benzyl)-6-methyl-2-phenyl-pyrimidin-4-yl]piperazino]propan-1-one Formula: C25H26ClFN4O MolecularWeight: 452.951543

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=NC(=NC(=C2CC3=C(C=CC=C3Cl)F)C)C4=CC=CC=C4

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=NC(=NC(=C2CC3=C(C=CC=C3Cl)F)C)C4=CC=CC=C4

InChI

InChI=1S/C25H26ClFN4O/c1-3-23(32)30-12-14-31(15-13-30)25-19(16-20-21(26)10-7-11-22(20)27)17(2)28-24(29-25)18-8-5-4-6-9-18/h4-11H,3,12-16H2,1-2H3