4-[4-(3,4-dichlorophenyl)piperazin-1-yl]-N-(2-pyridin-2-ylethyl)phthalazine-1-carboxamide

Systemtic Name: 4-[4-(3,4-dichlorophenyl)piperazin-1-yl]-N-(2-pyridin-2-ylethyl)phthalazine-1-carboxamide Openeye Name: 4-[4-(3,4-dichlorophenyl)piperazin-1-yl]-N-[2-(2-pyridyl)ethyl]phthalazine-1-carboxamide CAS Name: 4-[4-(3,4-dichlorophenyl)-1-piperazinyl]-N-[2-(2-pyridinyl)ethyl]-1-phthalazinecarboxamide IUPAC Name: 4-[4-(3,4-dichlorophenyl)piperazin-1-yl]-N-(2-pyridin-2-ylethyl)phthalazine-1-carboxamide Traditional Name: 4-[4-(3,4-dichlorophenyl)piperazino]-N-[2-(2-pyridyl)ethyl]phthalazine-1-carboxamide Formula: C26H24Cl2N6O MolecularWeight: 507.41436

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)Cl)Cl)C3=NN=C(C4=CC=CC=C43)C(=O)NCCC5=CC=CC=N5

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)Cl)Cl)C3=NN=C(C4=CC=CC=C43)C(=O)NCCC5=CC=CC=N5

InChI

InChI=1S/C26H24Cl2N6O/c27-22-9-8-19(17-23(22)28)33-13-15-34(16-14-33)25-21-7-2-1-6-20(21)24(31-32-25)26(35)30-12-10-18-5-3-4-11-29-18/h1-9,11,17H,10,12-16H2,(H,30,35)