N-(2-methylpropyl)-4,5-diphenyl-2H-pyrazolo[3,4-c]pyridazine-3-sulfonamide

Systemtic Name: N-(2-methylpropyl)-4,5-diphenyl-2H-pyrazolo[3,4-c]pyridazine-3-sulfonamide Openeye Name: N-isobutyl-4,5-diphenyl-2H-pyrazolo[3,4-c]pyridazine-3-sulfonamide CAS Name: N-(2-methylpropyl)-4,5-diphenyl-2H-pyrazolo[3,4-c]pyridazine-3-sulfonamide IUPAC Name: N-(2-methylpropyl)-4,5-diphenyl-2H-pyrazolo[3,4-c]pyridazine-3-sulfonamide Traditional Name: N-isobutyl-4,5-diphenyl-2H-pyrazolo[3,4-c]pyridazine-3-sulfonamide Formula: C21H21N5O2S MolecularWeight: 407.48874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNS(=O)(=O)C1=C2C(=C(N=NC2=NN1)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CNS(=O)(=O)C1=C2C(=C(N=NC2=NN1)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N5O2S/c1-14(2)13-22-29(27,28)21-18-17(15-9-5-3-6-10-15)19(16-11-7-4-8-12-16)23-24-20(18)25-26-21/h3-12,14,22H,13H2,1-2H3,(H,24,25,26)