4-[3,4-dimethyl-2-(4-methylphenyl)-7-oxidanylidene-pyrazolo[3,4-d]pyridazin-6-yl]-N-phenethyl-butanamide

Systemtic Name: 4-[3,4-dimethyl-2-(4-methylphenyl)-7-oxidanylidene-pyrazolo[3,4-d]pyridazin-6-yl]-N-phenethyl-butanamide Openeye Name: 4-[3,4-dimethyl-7-oxo-2-(p-tolyl)pyrazolo[3,4-d]pyridazin-6-yl]-N-phenethyl-butanamide CAS Name: 4-[3,4-dimethyl-2-(4-methylphenyl)-7-oxo-6-pyrazolo[3,4-d]pyridazinyl]-N-phenethylbutanamide IUPAC Name: 4-[3,4-dimethyl-2-(4-methylphenyl)-7-oxopyrazolo[3,4-d]pyridazin-6-yl]-N-phenethylbutanamide Traditional Name: 4-[7-keto-3,4-dimethyl-2-(p-tolyl)pyrazolo[3,4-d]pyridazin-6-yl]-N-phenethyl-butyramide Formula: C26H29N5O2 MolecularWeight: 443.54076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C3C(=NN(C(=O)C3=N2)CCCC(=O)NCCC4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C3C(=NN(C(=O)C3=N2)CCCC(=O)NCCC4=CC=CC=C4)C)C

InChI

InChI=1S/C26H29N5O2/c1-18-11-13-22(14-12-18)31-20(3)24-19(2)28-30(26(33)25(24)29-31)17-7-10-23(32)27-16-15-21-8-5-4-6-9-21/h4-6,8-9,11-14H,7,10,15-17H2,1-3H3,(H,27,32)