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

Systemtic Name: N-[(3-bromophenyl)methyl]-2-(3,4-dimethyl-7-oxidanylidene-2-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)propanamide Openeye Name: N-[(3-bromophenyl)methyl]-2-(3,4-dimethyl-7-oxo-2-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)propanamide CAS Name: N-[(3-bromophenyl)methyl]-2-(3,4-dimethyl-7-oxo-2-phenyl-6-pyrazolo[3,4-d]pyridazinyl)propanamide IUPAC Name: N-[(3-bromophenyl)methyl]-2-(3,4-dimethyl-7-oxo-2-phenylpyrazolo[3,4-d]pyridazin-6-yl)propanamide Traditional Name: N-(3-bromobenzyl)-2-(7-keto-3,4-dimethyl-2-phenyl-pyrazolo[3,4-d]pyridazin-6-yl)propionamide Formula: C23H22BrN5O2 MolecularWeight: 480.35708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22BrN5O2/c1-14-20-15(2)28(19-10-5-4-6-11-19)27-21(20)23(31)29(26-14)16(3)22(30)25-13-17-8-7-9-18(24)12-17/h4-12,16H,13H2,1-3H3,(H,25,30)