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

Systemtic Name: 4-chloranyl-2-(4-methylphenyl)sulfonyl-5-(4-propan-2-ylphenyl)sulfanyl-pyridazin-3-one Openeye Name: 4-chloro-5-(4-isopropylphenyl)sulfanyl-2-(p-tolylsulfonyl)pyridazin-3-one CAS Name: 4-chloro-2-(4-methylphenyl)sulfonyl-5-[(4-propan-2-ylphenyl)thio]-3-pyridazinone IUPAC Name: 4-chloro-2-(4-methylphenyl)sulfonyl-5-(4-propan-2-ylphenyl)sulfanylpyridazin-3-one Traditional Name: 4-chloro-5-(p-cumenylthio)-2-tosyl-pyridazin-3-one Formula: C20H19ClN2O3S2 MolecularWeight: 434.95946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(=O)C(=C(C=N2)SC3=CC=C(C=C3)C(C)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(=O)C(=C(C=N2)SC3=CC=C(C=C3)C(C)C)Cl

InChI

InChI=1S/C20H19ClN2O3S2/c1-13(2)15-6-8-16(9-7-15)27-18-12-22-23(20(24)19(18)21)28(25,26)17-10-4-14(3)5-11-17/h4-13H,1-3H3