4-[4-(4-fluorophenyl)piperazin-1-yl]-N-[2-(4-methoxyphenyl)ethyl]phthalazine-1-carboxamide

Systemtic Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-N-[2-(4-methoxyphenyl)ethyl]phthalazine-1-carboxamide Openeye Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-N-[2-(4-methoxyphenyl)ethyl]phthalazine-1-carboxamide CAS Name: 4-[4-(4-fluorophenyl)-1-piperazinyl]-N-[2-(4-methoxyphenyl)ethyl]-1-phthalazinecarboxamide IUPAC Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-N-[2-(4-methoxyphenyl)ethyl]phthalazine-1-carboxamide Traditional Name: 4-[4-(4-fluorophenyl)piperazino]-N-[2-(4-methoxyphenyl)ethyl]phthalazine-1-carboxamide Formula: C28H28FN5O2 MolecularWeight: 485.552623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)C2=NN=C(C3=CC=CC=C32)N4CCN(CC4)C5=CC=C(C=C5)F

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)C2=NN=C(C3=CC=CC=C32)N4CCN(CC4)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H28FN5O2/c1-36-23-12-6-20(7-13-23)14-15-30-28(35)26-24-4-2-3-5-25(24)27(32-31-26)34-18-16-33(17-19-34)22-10-8-21(29)9-11-22/h2-13H,14-19H2,1H3,(H,30,35)