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

Systemtic Name: [4-[5-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-6-methyl-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]-cyclobutyl-methanone Openeye Name: [4-[5-[(2-chloro-6-fluoro-phenyl)methyl]-6-methyl-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]-cyclobutyl-methanone CAS Name: [4-[5-[(2-chloro-6-fluorophenyl)methyl]-6-methyl-2-phenyl-4-pyrimidinyl]-1-piperazinyl]-cyclobutylmethanone IUPAC Name: [4-[5-[(2-chloro-6-fluorophenyl)methyl]-6-methyl-2-phenylpyrimidin-4-yl]piperazin-1-yl]-cyclobutylmethanone Traditional Name: [4-[5-(2-chloro-6-fluoro-benzyl)-6-methyl-2-phenyl-pyrimidin-4-yl]piperazino]-cyclobutyl-methanone Formula: C27H28ClFN4O MolecularWeight: 478.988823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)C(=O)C4CCC4)CC5=C(C=CC=C5Cl)F

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)C(=O)C4CCC4)CC5=C(C=CC=C5Cl)F

InChI

InChI=1S/C27H28ClFN4O/c1-18-21(17-22-23(28)11-6-12-24(22)29)26(31-25(30-18)19-7-3-2-4-8-19)32-13-15-33(16-14-32)27(34)20-9-5-10-20/h2-4,6-8,11-12,20H,5,9-10,13-17H2,1H3