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

Systemtic Name: 4-[4-(2-chlorophenyl)piperazin-1-yl]-N-(3-phenylpropyl)phthalazine-1-carboxamide Openeye Name: 4-[4-(2-chlorophenyl)piperazin-1-yl]-N-(3-phenylpropyl)phthalazine-1-carboxamide CAS Name: 4-[4-(2-chlorophenyl)-1-piperazinyl]-N-(3-phenylpropyl)-1-phthalazinecarboxamide IUPAC Name: 4-[4-(2-chlorophenyl)piperazin-1-yl]-N-(3-phenylpropyl)phthalazine-1-carboxamide Traditional Name: 4-[4-(2-chlorophenyl)piperazino]-N-(3-phenylpropyl)phthalazine-1-carboxamide Formula: C28H28ClN5O MolecularWeight: 486.00782

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2Cl)C3=NN=C(C4=CC=CC=C43)C(=O)NCCCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2Cl)C3=NN=C(C4=CC=CC=C43)C(=O)NCCCC5=CC=CC=C5

InChI

InChI=1S/C28H28ClN5O/c29-24-14-6-7-15-25(24)33-17-19-34(20-18-33)27-23-13-5-4-12-22(23)26(31-32-27)28(35)30-16-8-11-21-9-2-1-3-10-21/h1-7,9-10,12-15H,8,11,16-20H2,(H,30,35)