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

Systemtic Name: 4-[(4,5-diphenyl-2H-pyrazolo[3,4-c]pyridazin-3-yl)sulfonylamino]benzenesulfonic acid Openeye Name: 4-[(4,5-diphenyl-2H-pyrazolo[3,4-c]pyridazin-3-yl)sulfonylamino]benzenesulfonic acid CAS Name: 4-[(4,5-diphenyl-2H-pyrazolo[3,4-c]pyridazin-3-yl)sulfonylamino]benzenesulfonic acid IUPAC Name: 4-[(4,5-diphenyl-2H-pyrazolo[3,4-c]pyridazin-3-yl)sulfonylamino]benzenesulfonic acid Traditional Name: 4-[(4,5-diphenyl-2H-pyrazolo[3,4-c]pyridazin-3-yl)sulfonylamino]besylic acid Formula: C23H17N5O5S2 MolecularWeight: 507.54158

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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=C(C=C4)S(=O)(=O)O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=NC3=NNC(=C23)S(=O)(=O)NC4=CC=C(C=C4)S(=O)(=O)O)C5=CC=CC=C5

InChI

InChI=1S/C23H17N5O5S2/c29-34(30,28-17-11-13-18(14-12-17)35(31,32)33)23-20-19(15-7-3-1-4-8-15)21(16-9-5-2-6-10-16)24-25-22(20)26-27-23/h1-14,28H,(H,25,26,27)(H,31,32,33)