1-[[4-(4-chlorophenyl)carbonylphenyl]methyl]-7-methoxy-5-methyl-imidazo[4,5-d]pyridazin-4-one

Systemtic Name: 1-[[4-(4-chlorophenyl)carbonylphenyl]methyl]-7-methoxy-5-methyl-imidazo[4,5-d]pyridazin-4-one Openeye Name: 1-[[4-(4-chlorobenzoyl)phenyl]methyl]-7-methoxy-5-methyl-imidazo[4,5-d]pyridazin-4-one CAS Name: 1-[[4-[(4-chlorophenyl)-oxomethyl]phenyl]methyl]-7-methoxy-5-methyl-4-imidazo[4,5-d]pyridazinone IUPAC Name: 1-[[4-(4-chlorobenzoyl)phenyl]methyl]-7-methoxy-5-methylimidazo[4,5-d]pyridazin-4-one Traditional Name: 1-[4-(4-chlorobenzoyl)benzyl]-7-methoxy-5-methyl-imidazo[4,5-d]pyridazin-4-one Formula: C21H17ClN4O3 MolecularWeight: 408.83768

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C(=N1)OC)N(C=N2)CC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C(=O)C2=C(C(=N1)OC)N(C=N2)CC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H17ClN4O3/c1-25-21(28)17-18(20(24-25)29-2)26(12-23-17)11-13-3-5-14(6-4-13)19(27)15-7-9-16(22)10-8-15/h3-10,12H,11H2,1-2H3