2-[3-(3-acetamido-4-methyl-phenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(4-chloranyl-2-methyl-phenyl)ethanamide

Systemtic Name: 2-[3-(3-acetamido-4-methyl-phenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(4-chloranyl-2-methyl-phenyl)ethanamide Openeye Name: 2-[3-(3-acetamido-4-methyl-phenyl)-6-oxo-pyridazin-1-yl]-N-(4-chloro-2-methyl-phenyl)acetamide CAS Name: 2-[3-(3-acetamido-4-methylphenyl)-6-oxo-1-pyridazinyl]-N-(4-chloro-2-methylphenyl)acetamide IUPAC Name: 2-[3-(3-acetamido-4-methylphenyl)-6-oxopyridazin-1-yl]-N-(4-chloro-2-methylphenyl)acetamide Traditional Name: 2-[3-(3-acetamido-4-methyl-phenyl)-6-keto-pyridazin-1-yl]-N-(4-chloro-2-methyl-phenyl)acetamide Formula: C22H21ClN4O3 MolecularWeight: 424.88014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NC3=C(C=C(C=C3)Cl)C)NC(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NC3=C(C=C(C=C3)Cl)C)NC(=O)C

InChI

InChI=1S/C22H21ClN4O3/c1-13-4-5-16(11-20(13)24-15(3)28)19-8-9-22(30)27(26-19)12-21(29)25-18-7-6-17(23)10-14(18)2/h4-11H,12H2,1-3H3,(H,24,28)(H,25,29)