6-(4-methylphenyl)-2-[2-(4-propylsulfonylpiperazin-1-yl)ethyl]pyridazin-3-one

Systemtic Name: 6-(4-methylphenyl)-2-[2-(4-propylsulfonylpiperazin-1-yl)ethyl]pyridazin-3-one Openeye Name: 2-[2-(4-propylsulfonylpiperazin-1-yl)ethyl]-6-(p-tolyl)pyridazin-3-one CAS Name: 6-(4-methylphenyl)-2-[2-(4-propylsulfonyl-1-piperazinyl)ethyl]-3-pyridazinone IUPAC Name: 6-(4-methylphenyl)-2-[2-(4-propylsulfonylpiperazin-1-yl)ethyl]pyridazin-3-one Traditional Name: 2-[2-(4-propylsulfonylpiperazino)ethyl]-6-(p-tolyl)pyridazin-3-one Formula: C20H28N4O3S MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCN(CC1)CCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)C

Isomeric SMILES

CCCS(=O)(=O)N1CCN(CC1)CCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H28N4O3S/c1-3-16-28(26,27)23-13-10-22(11-14-23)12-15-24-20(25)9-8-19(21-24)18-6-4-17(2)5-7-18/h4-9H,3,10-16H2,1-2H3