1-(3,4-dimethylphenyl)-4-propan-2-yl-pyrazolo[3,4-d]pyridazine-7-thiolate

Systemtic Name: 1-(3,4-dimethylphenyl)-4-propan-2-yl-pyrazolo[3,4-d]pyridazine-7-thiolate Openeye Name: 1-(3,4-dimethylphenyl)-4-isopropyl-pyrazolo[3,4-d]pyridazine-7-thiolate CAS Name: 1-(3,4-dimethylphenyl)-4-propan-2-yl-7-pyrazolo[3,4-d]pyridazinethiolate IUPAC Name: 1-(3,4-dimethylphenyl)-4-propan-2-ylpyrazolo[3,4-d]pyridazine-7-thiolate Traditional Name: 1-(3,4-dimethylphenyl)-4-isopropyl-pyrazolo[3,4-d]pyridazine-7-thiolate Formula: C16H17N4S- MolecularWeight: 297.39798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NN=C3[S-])C(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NN=C3[S-])C(C)C)C

InChI

InChI=1S/C16H18N4S/c1-9(2)14-13-8-17-20(15(13)16(21)19-18-14)12-6-5-10(3)11(4)7-12/h5-9H,1-4H3,(H,19,21)/p-1