4-[4-(3-chlorophenyl)piperazin-1-yl]-N-[(4-fluorophenyl)methyl]phthalazine-1-carboxamide

Systemtic Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-[(4-fluorophenyl)methyl]phthalazine-1-carboxamide Openeye Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-[(4-fluorophenyl)methyl]phthalazine-1-carboxamide CAS Name: 4-[4-(3-chlorophenyl)-1-piperazinyl]-N-[(4-fluorophenyl)methyl]-1-phthalazinecarboxamide IUPAC Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-[(4-fluorophenyl)methyl]phthalazine-1-carboxamide Traditional Name: 4-[4-(3-chlorophenyl)piperazino]-N-(4-fluorobenzyl)phthalazine-1-carboxamide Formula: C26H23ClFN5O MolecularWeight: 475.945123

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H23ClFN5O/c27-19-4-3-5-21(16-19)32-12-14-33(15-13-32)25-23-7-2-1-6-22(23)24(30-31-25)26(34)29-17-18-8-10-20(28)11-9-18/h1-11,16H,12-15,17H2,(H,29,34)