2-(1-benzothiophen-2-ylmethyl)-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one

Systemtic Name: 2-(1-benzothiophen-2-ylmethyl)-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one Openeye Name: 2-(benzothiophen-2-ylmethyl)-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one CAS Name: 2-(1-benzothiophen-2-ylmethyl)-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-3-pyridazinone IUPAC Name: 2-(1-benzothiophen-2-ylmethyl)-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one Traditional Name: 2-(benzothiophen-2-ylmethyl)-4-(4-fluorophenyl)-5-(4-mesylphenyl)pyridazin-3-one Formula: C26H19FN2O3S2 MolecularWeight: 490.569063

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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=CC4=CC=CC=C4S3)C5=CC=C(C=C5)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N(N=C2)CC3=CC4=CC=CC=C4S3)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H19FN2O3S2/c1-34(31,32)22-12-8-17(9-13-22)23-15-28-29(16-21-14-19-4-2-3-5-24(19)33-21)26(30)25(23)18-6-10-20(27)11-7-18/h2-15H,16H2,1H3