N-[(4-fluorophenyl)methyl]-4-[4-(4-fluorophenyl)piperazin-1-yl]phthalazine-1-carboxamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-4-[4-(4-fluorophenyl)piperazin-1-yl]phthalazine-1-carboxamide Openeye Name: N-[(4-fluorophenyl)methyl]-4-[4-(4-fluorophenyl)piperazin-1-yl]phthalazine-1-carboxamide CAS Name: N-[(4-fluorophenyl)methyl]-4-[4-(4-fluorophenyl)-1-piperazinyl]-1-phthalazinecarboxamide IUPAC Name: N-[(4-fluorophenyl)methyl]-4-[4-(4-fluorophenyl)piperazin-1-yl]phthalazine-1-carboxamide Traditional Name: N-(4-fluorobenzyl)-4-[4-(4-fluorophenyl)piperazino]phthalazine-1-carboxamide Formula: C26H23F2N5O MolecularWeight: 459.490526

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C3=NN=C(C4=CC=CC=C43)C(=O)NCC5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C3=NN=C(C4=CC=CC=C43)C(=O)NCC5=CC=C(C=C5)F

InChI

InChI=1S/C26H23F2N5O/c27-19-7-5-18(6-8-19)17-29-26(34)24-22-3-1-2-4-23(22)25(31-30-24)33-15-13-32(14-16-33)21-11-9-20(28)10-12-21/h1-12H,13-17H2,(H,29,34)