N-(3-chlorophenyl)-4-[4-(2-fluorophenyl)piperazin-1-yl]phthalazine-1-carboxamide

Systemtic Name: N-(3-chlorophenyl)-4-[4-(2-fluorophenyl)piperazin-1-yl]phthalazine-1-carboxamide Openeye Name: N-(3-chlorophenyl)-4-[4-(2-fluorophenyl)piperazin-1-yl]phthalazine-1-carboxamide CAS Name: N-(3-chlorophenyl)-4-[4-(2-fluorophenyl)-1-piperazinyl]-1-phthalazinecarboxamide IUPAC Name: N-(3-chlorophenyl)-4-[4-(2-fluorophenyl)piperazin-1-yl]phthalazine-1-carboxamide Traditional Name: N-(3-chlorophenyl)-4-[4-(2-fluorophenyl)piperazino]phthalazine-1-carboxamide Formula: C25H21ClFN5O MolecularWeight: 461.918543

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2F)C3=NN=C(C4=CC=CC=C43)C(=O)NC5=CC(=CC=C5)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2F)C3=NN=C(C4=CC=CC=C43)C(=O)NC5=CC(=CC=C5)Cl

InChI

InChI=1S/C25H21ClFN5O/c26-17-6-5-7-18(16-17)28-25(33)23-19-8-1-2-9-20(19)24(30-29-23)32-14-12-31(13-15-32)22-11-4-3-10-21(22)27/h1-11,16H,12-15H2,(H,28,33)