4-(5-bromanylpyrimidin-2-yl)-N-[4-(trifluoromethyloxy)phenyl]piperazine-1-carboxamide

Systemtic Name: 4-(5-bromanylpyrimidin-2-yl)-N-[4-(trifluoromethyloxy)phenyl]piperazine-1-carboxamide Openeye Name: 4-(5-bromopyrimidin-2-yl)-N-[4-(trifluoromethoxy)phenyl]piperazine-1-carboxamide CAS Name: 4-(5-bromo-2-pyrimidinyl)-N-[4-(trifluoromethoxy)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-(5-bromopyrimidin-2-yl)-N-[4-(trifluoromethoxy)phenyl]piperazine-1-carboxamide Traditional Name: 4-(5-bromopyrimidin-2-yl)-N-[4-(trifluoromethoxy)phenyl]piperazine-1-carboxamide Formula: C16H15BrF3N5O2 MolecularWeight: 446.22181

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=N2)Br)C(=O)NC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=N2)Br)C(=O)NC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C16H15BrF3N5O2/c17-11-9-21-14(22-10-11)24-5-7-25(8-6-24)15(26)23-12-1-3-13(4-2-12)27-16(18,19)20/h1-4,9-10H,5-8H2,(H,23,26)