2-(cyclobutylmethyl)-6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one

Systemtic Name: 2-(cyclobutylmethyl)-6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one Openeye Name: 2-(cyclobutylmethyl)-6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one CAS Name: 2-(cyclobutylmethyl)-6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-3-pyridazinone IUPAC Name: 2-(cyclobutylmethyl)-6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyridazin-3-one Traditional Name: 2-(cyclobutylmethyl)-6-(4-fluorophenyl)-5-(4-mesylphenyl)pyridazin-3-one Formula: C22H21FN2O3S MolecularWeight: 412.477143

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=O)N(N=C2C3=CC=C(C=C3)F)CC4CCC4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=O)N(N=C2C3=CC=C(C=C3)F)CC4CCC4

InChI

InChI=1S/C22H21FN2O3S/c1-29(27,28)19-11-7-16(8-12-19)20-13-21(26)25(14-15-3-2-4-15)24-22(20)17-5-9-18(23)10-6-17/h5-13,15H,2-4,14H2,1H3