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

Systemtic Name: 2-(phenylmethyl)-6-[4-(phenylmethyl)sulfonylpiperazin-1-yl]carbonyl-pyridazin-3-one Openeye Name: 2-benzyl-6-(4-benzylsulfonylpiperazine-1-carbonyl)pyridazin-3-one CAS Name: 6-[oxo-[4-(phenylmethyl)sulfonyl-1-piperazinyl]methyl]-2-(phenylmethyl)-3-pyridazinone IUPAC Name: 2-benzyl-6-(4-benzylsulfonylpiperazine-1-carbonyl)pyridazin-3-one Traditional Name: 2-benzyl-6-(4-benzylsulfonylpiperazine-1-carbonyl)pyridazin-3-one Formula: C23H24N4O4S MolecularWeight: 452.52606

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=NN(C(=O)C=C2)CC3=CC=CC=C3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)C2=NN(C(=O)C=C2)CC3=CC=CC=C3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H24N4O4S/c28-22-12-11-21(24-27(22)17-19-7-3-1-4-8-19)23(29)25-13-15-26(16-14-25)32(30,31)18-20-9-5-2-6-10-20/h1-12H,13-18H2