4-(4-fluorophenyl)-5-(3-methylsulfonylphenyl)-2-phenethyl-pyridazin-3-one

Systemtic Name: 4-(4-fluorophenyl)-5-(3-methylsulfonylphenyl)-2-phenethyl-pyridazin-3-one Openeye Name: 4-(4-fluorophenyl)-5-(3-methylsulfonylphenyl)-2-phenethyl-pyridazin-3-one CAS Name: 4-(4-fluorophenyl)-5-(3-methylsulfonylphenyl)-2-phenethyl-3-pyridazinone IUPAC Name: 4-(4-fluorophenyl)-5-(3-methylsulfonylphenyl)-2-phenethylpyridazin-3-one Traditional Name: 4-(4-fluorophenyl)-5-(3-mesylphenyl)-2-phenethyl-pyridazin-3-one Formula: C25H21FN2O3S MolecularWeight: 448.509243

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C2=C(C(=O)N(N=C2)CCC3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C2=C(C(=O)N(N=C2)CCC3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H21FN2O3S/c1-32(30,31)22-9-5-8-20(16-22)23-17-27-28(15-14-18-6-3-2-4-7-18)25(29)24(23)19-10-12-21(26)13-11-19/h2-13,16-17H,14-15H2,1H3