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

Systemtic Name: 4-[5-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-6-(methoxymethyl)-2-phenyl-pyrimidin-4-yl]-N-propan-2-yl-piperazine-1-carboxamide Openeye Name: 4-[5-[(2-chloro-6-fluoro-phenyl)methyl]-6-(methoxymethyl)-2-phenyl-pyrimidin-4-yl]-N-isopropyl-piperazine-1-carboxamide CAS Name: 4-[5-[(2-chloro-6-fluorophenyl)methyl]-6-(methoxymethyl)-2-phenyl-4-pyrimidinyl]-N-propan-2-yl-1-piperazinecarboxamide IUPAC Name: 4-[5-[(2-chloro-6-fluorophenyl)methyl]-6-(methoxymethyl)-2-phenylpyrimidin-4-yl]-N-propan-2-ylpiperazine-1-carboxamide Traditional Name: 4-[5-(2-chloro-6-fluoro-benzyl)-6-(methoxymethyl)-2-phenyl-pyrimidin-4-yl]-N-isopropyl-piperazine-1-carboxamide Formula: C27H31ClFN5O2 MolecularWeight: 512.018743

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H31ClFN5O2/c1-18(2)30-27(35)34-14-12-33(13-15-34)26-21(16-20-22(28)10-7-11-23(20)29)24(17-36-3)31-25(32-26)19-8-5-4-6-9-19/h4-11,18H,12-17H2,1-3H3,(H,30,35)