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

Systemtic Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-N-(1-phenylethyl)phthalazine-1-carboxamide Openeye Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-N-(1-phenylethyl)phthalazine-1-carboxamide CAS Name: 4-[4-(4-fluorophenyl)-1-piperazinyl]-N-(1-phenylethyl)-1-phthalazinecarboxamide IUPAC Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-N-(1-phenylethyl)phthalazine-1-carboxamide Traditional Name: 4-[4-(4-fluorophenyl)piperazino]-N-(1-phenylethyl)phthalazine-1-carboxamide Formula: C27H26FN5O MolecularWeight: 455.526643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H26FN5O/c1-19(20-7-3-2-4-8-20)29-27(34)25-23-9-5-6-10-24(23)26(31-30-25)33-17-15-32(16-18-33)22-13-11-21(28)12-14-22/h2-14,19H,15-18H2,1H3,(H,29,34)