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

Systemtic Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(1-phenylethyl)phthalazine-1-carboxamide Openeye Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(1-phenylethyl)phthalazine-1-carboxamide CAS Name: 4-[4-(3-chlorophenyl)-1-piperazinyl]-N-(1-phenylethyl)-1-phthalazinecarboxamide IUPAC Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(1-phenylethyl)phthalazine-1-carboxamide Traditional Name: 4-[4-(3-chlorophenyl)piperazino]-N-(1-phenylethyl)phthalazine-1-carboxamide Formula: C27H26ClN5O MolecularWeight: 471.98124

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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(=CC=C5)Cl

Isomeric SMILES

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

InChI

InChI=1S/C27H26ClN5O/c1-19(20-8-3-2-4-9-20)29-27(34)25-23-12-5-6-13-24(23)26(31-30-25)33-16-14-32(15-17-33)22-11-7-10-21(28)18-22/h2-13,18-19H,14-17H2,1H3,(H,29,34)