2-[(4,5-diphenyl-2H-pyrazolo[3,4-c]pyridazin-3-yl)sulfonylamino]benzoic acid

Systemtic Name: 2-[(4,5-diphenyl-2H-pyrazolo[3,4-c]pyridazin-3-yl)sulfonylamino]benzoic acid Openeye Name: 2-[(4,5-diphenyl-2H-pyrazolo[3,4-c]pyridazin-3-yl)sulfonylamino]benzoic acid CAS Name: 2-[(4,5-diphenyl-2H-pyrazolo[3,4-c]pyridazin-3-yl)sulfonylamino]benzoic acid IUPAC Name: 2-[(4,5-diphenyl-2H-pyrazolo[3,4-c]pyridazin-3-yl)sulfonylamino]benzoic acid Traditional Name: 2-[(4,5-diphenyl-2H-pyrazolo[3,4-c]pyridazin-3-yl)sulfonylamino]benzoic acid Formula: C24H17N5O4S MolecularWeight: 471.48788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=NC3=NNC(=C23)S(=O)(=O)NC4=CC=CC=C4C(=O)O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=NC3=NNC(=C23)S(=O)(=O)NC4=CC=CC=C4C(=O)O)C5=CC=CC=C5

InChI

InChI=1S/C24H17N5O4S/c30-24(31)17-13-7-8-14-18(17)29-34(32,33)23-20-19(15-9-3-1-4-10-15)21(16-11-5-2-6-12-16)25-26-22(20)27-28-23/h1-14,29H,(H,30,31)(H,26,27,28)