3-(3,5-dimethylpyrazol-1-yl)-6-[4-(3-methylphenyl)sulfonylpiperazin-1-yl]pyridazine

Systemtic Name: 3-(3,5-dimethylpyrazol-1-yl)-6-[4-(3-methylphenyl)sulfonylpiperazin-1-yl]pyridazine Openeye Name: 3-(3,5-dimethylpyrazol-1-yl)-6-[4-(m-tolylsulfonyl)piperazin-1-yl]pyridazine CAS Name: 3-(3,5-dimethyl-1-pyrazolyl)-6-[4-(3-methylphenyl)sulfonyl-1-piperazinyl]pyridazine IUPAC Name: 3-(3,5-dimethylpyrazol-1-yl)-6-[4-(3-methylphenyl)sulfonylpiperazin-1-yl]pyridazine Traditional Name: 3-(3,5-dimethylpyrazol-1-yl)-6-[4-(m-tolylsulfonyl)piperazino]pyridazine Formula: C20H24N6O2S MolecularWeight: 412.50856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)C3=NN=C(C=C3)N4C(=CC(=N4)C)C

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)C3=NN=C(C=C3)N4C(=CC(=N4)C)C

InChI

InChI=1S/C20H24N6O2S/c1-15-5-4-6-18(13-15)29(27,28)25-11-9-24(10-12-25)19-7-8-20(22-21-19)26-17(3)14-16(2)23-26/h4-8,13-14H,9-12H2,1-3H3