4,5-bis(chloranyl)-2-[2-oxidanylidene-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]pyridazin-3-one

Systemtic Name: 4,5-bis(chloranyl)-2-[2-oxidanylidene-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]pyridazin-3-one Openeye Name: 4,5-dichloro-2-[2-oxo-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]pyridazin-3-one CAS Name: 4,5-dichloro-2-[2-oxo-2-[4-(1-pyrrolidinylsulfonyl)phenyl]ethyl]-3-pyridazinone IUPAC Name: 4,5-dichloro-2-[2-oxo-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]pyridazin-3-one Traditional Name: 4,5-dichloro-2-[2-keto-2-(4-pyrrolidinosulfonylphenyl)ethyl]pyridazin-3-one Formula: C16H15Cl2N3O4S MolecularWeight: 416.279

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)CN3C(=O)C(=C(C=N3)Cl)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)CN3C(=O)C(=C(C=N3)Cl)Cl

InChI

InChI=1S/C16H15Cl2N3O4S/c17-13-9-19-21(16(23)15(13)18)10-14(22)11-3-5-12(6-4-11)26(24,25)20-7-1-2-8-20/h3-6,9H,1-2,7-8,10H2