3-phenyl-4-[4-(phenylsulfonyl)piperazin-1-yl]-1H-pyridazin-6-one

Systemtic Name: 3-phenyl-4-[4-(phenylsulfonyl)piperazin-1-yl]-1H-pyridazin-6-one Openeye Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-3-phenyl-1H-pyridazin-6-one CAS Name: 4-[4-(benzenesulfonyl)-1-piperazinyl]-3-phenyl-1H-pyridazin-6-one IUPAC Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-3-phenyl-1H-pyridazin-6-one Traditional Name: 4-(4-besylpiperazino)-3-phenyl-1H-pyridazin-6-one Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=O)NN=C2C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC(=O)NN=C2C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H20N4O3S/c25-19-15-18(20(22-21-19)16-7-3-1-4-8-16)23-11-13-24(14-12-23)28(26,27)17-9-5-2-6-10-17/h1-10,15H,11-14H2,(H,21,25)