3,7-dimethyl-5-(4-methylphenyl)sulfonyl-2-phenyl-pyrazolo[3,4-d]pyridazin-4-one

Systemtic Name: 3,7-dimethyl-5-(4-methylphenyl)sulfonyl-2-phenyl-pyrazolo[3,4-d]pyridazin-4-one Openeye Name: 3,7-dimethyl-2-phenyl-5-(p-tolylsulfonyl)pyrazolo[3,4-d]pyridazin-4-one CAS Name: 3,7-dimethyl-5-(4-methylphenyl)sulfonyl-2-phenyl-4-pyrazolo[3,4-d]pyridazinone IUPAC Name: 3,7-dimethyl-5-(4-methylphenyl)sulfonyl-2-phenylpyrazolo[3,4-d]pyridazin-4-one Traditional Name: 3,7-dimethyl-2-phenyl-5-tosyl-pyrazolo[3,4-d]pyridazin-4-one Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(=O)C3=C(N(N=C3C(=N2)C)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(=O)C3=C(N(N=C3C(=N2)C)C4=CC=CC=C4)C

InChI

InChI=1S/C20H18N4O3S/c1-13-9-11-17(12-10-13)28(26,27)24-20(25)18-15(3)23(16-7-5-4-6-8-16)22-19(18)14(2)21-24/h4-12H,1-3H3