1-phenyl-4-propan-2-yl-pyrazolo[3,4-d]pyridazine-7-thiolate

Systemtic Name: 1-phenyl-4-propan-2-yl-pyrazolo[3,4-d]pyridazine-7-thiolate Openeye Name: 4-isopropyl-1-phenyl-pyrazolo[3,4-d]pyridazine-7-thiolate CAS Name: 1-phenyl-4-propan-2-yl-7-pyrazolo[3,4-d]pyridazinethiolate IUPAC Name: 1-phenyl-4-propan-2-ylpyrazolo[3,4-d]pyridazine-7-thiolate Traditional Name: 4-isopropyl-1-phenyl-pyrazolo[3,4-d]pyridazine-7-thiolate Formula: C14H13N4S- MolecularWeight: 269.34482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(C2=C1C=NN2C3=CC=CC=C3)[S-]

Isomeric SMILES

CC(C)C1=NN=C(C2=C1C=NN2C3=CC=CC=C3)[S-]

InChI

InChI=1S/C14H14N4S/c1-9(2)12-11-8-15-18(10-6-4-3-5-7-10)13(11)14(19)17-16-12/h3-9H,1-2H3,(H,17,19)/p-1