N-tert-butyl-4-[5-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-6-methyl-2-phenyl-pyrimidin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-tert-butyl-4-[5-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-6-methyl-2-phenyl-pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: N-tert-butyl-4-[5-[(2-chloro-6-fluoro-phenyl)methyl]-6-methyl-2-phenyl-pyrimidin-4-yl]piperazine-1-carboxamide CAS Name: N-tert-butyl-4-[5-[(2-chloro-6-fluorophenyl)methyl]-6-methyl-2-phenyl-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-tert-butyl-4-[5-[(2-chloro-6-fluorophenyl)methyl]-6-methyl-2-phenylpyrimidin-4-yl]piperazine-1-carboxamide Traditional Name: N-tert-butyl-4-[5-(2-chloro-6-fluoro-benzyl)-6-methyl-2-phenyl-pyrimidin-4-yl]piperazine-1-carboxamide Formula: C27H31ClFN5O MolecularWeight: 496.019343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)C(=O)NC(C)(C)C)CC4=C(C=CC=C4Cl)F

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)C(=O)NC(C)(C)C)CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C27H31ClFN5O/c1-18-20(17-21-22(28)11-8-12-23(21)29)25(31-24(30-18)19-9-6-5-7-10-19)33-13-15-34(16-14-33)26(35)32-27(2,3)4/h5-12H,13-17H2,1-4H3,(H,32,35)