4-chloranyl-5-(4-propan-2-ylphenyl)sulfanyl-2-(4-propan-2-ylphenyl)sulfonyl-4H-pyridazin-2-ium-3-one

Systemtic Name: 4-chloranyl-5-(4-propan-2-ylphenyl)sulfanyl-2-(4-propan-2-ylphenyl)sulfonyl-4H-pyridazin-2-ium-3-one Openeye Name: 4-chloro-5-(4-isopropylphenyl)sulfanyl-2-(4-isopropylphenyl)sulfonyl-4H-pyridazin-2-ium-3-one CAS Name: 4-chloro-2-(4-propan-2-ylphenyl)sulfonyl-5-[(4-propan-2-ylphenyl)thio]-4H-pyridazin-2-ium-3-one IUPAC Name: 4-chloro-5-(4-propan-2-ylphenyl)sulfanyl-2-(4-propan-2-ylphenyl)sulfonyl-4H-pyridazin-2-ium-3-one Traditional Name: 4-chloro-2-p-cumenylsulfonyl-5-(p-cumenylthio)-4H-pyridazin-2-ium-3-one Formula: C22H24ClN2O3S2+ MolecularWeight: 464.02056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)SC2=CN=[N+](C(=O)C2Cl)S(=O)(=O)C3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)SC2=CN=[N+](C(=O)C2Cl)S(=O)(=O)C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C22H24ClN2O3S2/c1-14(2)16-5-9-18(10-6-16)29-20-13-24-25(22(26)21(20)23)30(27,28)19-11-7-17(8-12-19)15(3)4/h5-15,21H,1-4H3/q+1