4-phthalazin-1-yl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide

Systemtic Name: 4-phthalazin-1-yl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Openeye Name: 4-phthalazin-1-yl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide CAS Name: 4-(1-phthalazinyl)-N-[4-(trifluoromethyl)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-phthalazin-1-yl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Traditional Name: 4-phthalazin-1-yl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide Formula: C20H18F3N5O MolecularWeight: 401.38503

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=CC3=CC=CC=C32)C(=O)NC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=NN=CC3=CC=CC=C32)C(=O)NC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C20H18F3N5O/c21-20(22,23)15-5-7-16(8-6-15)25-19(29)28-11-9-27(10-12-28)18-17-4-2-1-3-14(17)13-24-26-18/h1-8,13H,9-12H2,(H,25,29)