2-(2,3-dihydro-1H-inden-1-yl)-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one

Systemtic Name: 2-(2,3-dihydro-1H-inden-1-yl)-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one Openeye Name: 4-(4-fluorophenyl)-2-indan-1-yl-5-(4-methylsulfonylphenyl)pyridazin-3-one CAS Name: 2-(2,3-dihydro-1H-inden-1-yl)-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-3-pyridazinone IUPAC Name: 2-(2,3-dihydro-1H-inden-1-yl)-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one Traditional Name: 4-(4-fluorophenyl)-2-indan-1-yl-5-(4-mesylphenyl)pyridazin-3-one Formula: C26H21FN2O3S MolecularWeight: 460.519943

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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)C3CCC4=CC=CC=C34)C5=CC=C(C=C5)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)N(N=C2)C3CCC4=CC=CC=C34)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H21FN2O3S/c1-33(31,32)21-13-8-18(9-14-21)23-16-28-29(24-15-10-17-4-2-3-5-22(17)24)26(30)25(23)19-6-11-20(27)12-7-19/h2-9,11-14,16,24H,10,15H2,1H3