N-[(3-bromophenyl)methyl]-2-(3,4-dimethyl-7-oxidanylidene-2-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)ethanamide

Systemtic Name: N-[(3-bromophenyl)methyl]-2-(3,4-dimethyl-7-oxidanylidene-2-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)ethanamide Openeye Name: N-[(3-bromophenyl)methyl]-2-(3,4-dimethyl-7-oxo-2-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)acetamide CAS Name: N-[(3-bromophenyl)methyl]-2-(3,4-dimethyl-7-oxo-2-phenyl-6-pyrazolo[3,4-d]pyridazinyl)acetamide IUPAC Name: N-[(3-bromophenyl)methyl]-2-(3,4-dimethyl-7-oxo-2-phenylpyrazolo[3,4-d]pyridazin-6-yl)acetamide Traditional Name: N-(3-bromobenzyl)-2-(7-keto-3,4-dimethyl-2-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)acetamide Formula: C22H20BrN5O2 MolecularWeight: 466.3305

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NN(C(=O)C2=NN1C3=CC=CC=C3)CC(=O)NCC4=CC(=CC=C4)Br)C

Isomeric SMILES

CC1=C2C(=NN(C(=O)C2=NN1C3=CC=CC=C3)CC(=O)NCC4=CC(=CC=C4)Br)C

InChI

InChI=1S/C22H20BrN5O2/c1-14-20-15(2)28(18-9-4-3-5-10-18)26-21(20)22(30)27(25-14)13-19(29)24-12-16-7-6-8-17(23)11-16/h3-11H,12-13H2,1-2H3,(H,24,29)