2-(4-aminophenyl)-3,4,6-triphenyl-pyrazolo[3,4-d]pyridazin-7-one

Systemtic Name: 2-(4-aminophenyl)-3,4,6-triphenyl-pyrazolo[3,4-d]pyridazin-7-one Openeye Name: 2-(4-aminophenyl)-3,4,6-triphenyl-pyrazolo[3,4-d]pyridazin-7-one CAS Name: 2-(4-aminophenyl)-3,4,6-triphenyl-7-pyrazolo[3,4-d]pyridazinone IUPAC Name: 2-(4-aminophenyl)-3,4,6-triphenylpyrazolo[3,4-d]pyridazin-7-one Traditional Name: 2-(4-aminophenyl)-3,4,6-triphenyl-pyrazolo[3,4-d]pyridazin-7-one Formula: C29H21N5O MolecularWeight: 455.50994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C(=NN(C(=O)C3=NN2C4=CC=C(C=C4)N)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C(=NN(C(=O)C3=NN2C4=CC=C(C=C4)N)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C29H21N5O/c30-22-16-18-24(19-17-22)33-28(21-12-6-2-7-13-21)25-26(20-10-4-1-5-11-20)31-34(29(35)27(25)32-33)23-14-8-3-9-15-23/h1-19H,30H2