2-[4-(4-chlorophenyl)-1-oxidanylidene-phthalazin-2-yl]-N-[5-(3-methyl-4-oxidanylidene-phthalazin-1-yl)-2-piperidin-1-yl-phenyl]ethanamide

Systemtic Name: 2-[4-(4-chlorophenyl)-1-oxidanylidene-phthalazin-2-yl]-N-[5-(3-methyl-4-oxidanylidene-phthalazin-1-yl)-2-piperidin-1-yl-phenyl]ethanamide Openeye Name: 2-[4-(4-chlorophenyl)-1-oxo-phthalazin-2-yl]-N-[5-(3-methyl-4-oxo-phthalazin-1-yl)-2-(1-piperidyl)phenyl]acetamide CAS Name: 2-[4-(4-chlorophenyl)-1-oxo-2-phthalazinyl]-N-[5-(3-methyl-4-oxo-1-phthalazinyl)-2-(1-piperidinyl)phenyl]acetamide IUPAC Name: 2-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-[5-(3-methyl-4-oxophthalazin-1-yl)-2-piperidin-1-ylphenyl]acetamide Traditional Name: 2-[4-(4-chlorophenyl)-1-keto-phthalazin-2-yl]-N-[5-(4-keto-3-methyl-phthalazin-1-yl)-2-piperidino-phenyl]acetamide Formula: C36H31ClN6O3 MolecularWeight: 631.12274

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C3=CC(=C(C=C3)N4CCCCC4)NC(=O)CN5C(=O)C6=CC=CC=C6C(=N5)C7=CC=C(C=C7)Cl

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C3=CC(=C(C=C3)N4CCCCC4)NC(=O)CN5C(=O)C6=CC=CC=C6C(=N5)C7=CC=C(C=C7)Cl

InChI

InChI=1S/C36H31ClN6O3/c1-41-35(45)28-11-5-3-9-26(28)34(39-41)24-15-18-31(42-19-7-2-8-20-42)30(21-24)38-32(44)22-43-36(46)29-12-6-4-10-27(29)33(40-43)23-13-16-25(37)17-14-23/h3-6,9-18,21H,2,7-8,19-20,22H2,1H3,(H,38,44)