N-(5-bromanylquinolin-8-yl)-2-[4-(4-chlorophenyl)-1-oxidanylidene-phthalazin-2-yl]ethanamide

Systemtic Name: N-(5-bromanylquinolin-8-yl)-2-[4-(4-chlorophenyl)-1-oxidanylidene-phthalazin-2-yl]ethanamide Openeye Name: N-(5-bromo-8-quinolyl)-2-[4-(4-chlorophenyl)-1-oxo-phthalazin-2-yl]acetamide CAS Name: N-(5-bromo-8-quinolinyl)-2-[4-(4-chlorophenyl)-1-oxo-2-phthalazinyl]acetamide IUPAC Name: N-(5-bromoquinolin-8-yl)-2-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]acetamide Traditional Name: N-(5-bromo-8-quinolyl)-2-[4-(4-chlorophenyl)-1-keto-phthalazin-2-yl]acetamide Formula: C25H16BrClN4O2 MolecularWeight: 519.77714

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)NC3=C4C(=C(C=C3)Br)C=CC=N4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)NC3=C4C(=C(C=C3)Br)C=CC=N4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H16BrClN4O2/c26-20-11-12-21(24-19(20)6-3-13-28-24)29-22(32)14-31-25(33)18-5-2-1-4-17(18)23(30-31)15-7-9-16(27)10-8-15/h1-13H,14H2,(H,29,32)