3-[4-(phenylmethyl)sulfonylpiperazin-1-yl]carbonyl-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: 3-[4-(phenylmethyl)sulfonylpiperazin-1-yl]carbonyl-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 3-(4-benzylsulfonylpiperazine-1-carbonyl)-4,5-dihydro-1H-pyridazin-6-one CAS Name: 3-[oxo-[4-(phenylmethyl)sulfonyl-1-piperazinyl]methyl]-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 3-(4-benzylsulfonylpiperazine-1-carbonyl)-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 3-(4-benzylsulfonylpiperazine-1-carbonyl)-4,5-dihydro-1H-pyridazin-6-one Formula: C16H20N4O4S MolecularWeight: 364.4194

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NN=C1C(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CC(=O)NN=C1C(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C16H20N4O4S/c21-15-7-6-14(17-18-15)16(22)19-8-10-20(11-9-19)25(23,24)12-13-4-2-1-3-5-13/h1-5H,6-12H2,(H,18,21)