2-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-6-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)pyridazin-3-one

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-6-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)pyridazin-3-one Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methyl]-6-(4-methyl-3-morpholinosulfonyl-phenyl)pyridazin-3-one CAS Name: 2-[(2-chloro-6-fluorophenyl)methyl]-6-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-3-pyridazinone IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methyl]-6-(4-methyl-3-morpholin-4-ylsulfonylphenyl)pyridazin-3-one Traditional Name: 2-(2-chloro-6-fluoro-benzyl)-6-(4-methyl-3-morpholinosulfonyl-phenyl)pyridazin-3-one Formula: C22H21ClFN3O4S MolecularWeight: 477.936243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CC3=C(C=CC=C3Cl)F)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CC3=C(C=CC=C3Cl)F)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H21ClFN3O4S/c1-15-5-6-16(13-21(15)32(29,30)26-9-11-31-12-10-26)20-7-8-22(28)27(25-20)14-17-18(23)3-2-4-19(17)24/h2-8,13H,9-12,14H2,1H3