2-methyl-6-[4-(phenylmethyl)sulfonylpiperazin-1-yl]carbonyl-pyridazin-3-one

Systemtic Name: 2-methyl-6-[4-(phenylmethyl)sulfonylpiperazin-1-yl]carbonyl-pyridazin-3-one Openeye Name: 6-(4-benzylsulfonylpiperazine-1-carbonyl)-2-methyl-pyridazin-3-one CAS Name: 2-methyl-6-[oxo-[4-(phenylmethyl)sulfonyl-1-piperazinyl]methyl]-3-pyridazinone IUPAC Name: 6-(4-benzylsulfonylpiperazine-1-carbonyl)-2-methylpyridazin-3-one Traditional Name: 6-(4-benzylsulfonylpiperazine-1-carbonyl)-2-methyl-pyridazin-3-one Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=CC(=N1)C(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CN1C(=O)C=CC(=N1)C(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C17H20N4O4S/c1-19-16(22)8-7-15(18-19)17(23)20-9-11-21(12-10-20)26(24,25)13-14-5-3-2-4-6-14/h2-8H,9-13H2,1H3