5-(4-methylsulfonylphenyl)-2-(phenylmethyl)-4-phenylsulfanyl-pyridazin-3-one

Systemtic Name: 5-(4-methylsulfonylphenyl)-2-(phenylmethyl)-4-phenylsulfanyl-pyridazin-3-one Openeye Name: 2-benzyl-5-(4-methylsulfonylphenyl)-4-phenylsulfanyl-pyridazin-3-one CAS Name: 5-(4-methylsulfonylphenyl)-2-(phenylmethyl)-4-(phenylthio)-3-pyridazinone IUPAC Name: 2-benzyl-5-(4-methylsulfonylphenyl)-4-phenylsulfanylpyridazin-3-one Traditional Name: 2-benzyl-5-(4-mesylphenyl)-4-(phenylthio)pyridazin-3-one Formula: C24H20N2O3S2 MolecularWeight: 448.5572

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N(N=C2)CC3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N(N=C2)CC3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C24H20N2O3S2/c1-31(28,29)21-14-12-19(13-15-21)22-16-25-26(17-18-8-4-2-5-9-18)24(27)23(22)30-20-10-6-3-7-11-20/h2-16H,17H2,1H3