2-[2-(4-fluoranylphenoxy)ethyl]-6-(4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)pyridazin-3-one

Systemtic Name: 2-[2-(4-fluoranylphenoxy)ethyl]-6-(4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)pyridazin-3-one Openeye Name: 2-[2-(4-fluorophenoxy)ethyl]-6-(4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)pyridazin-3-one CAS Name: 2-[2-(4-fluorophenoxy)ethyl]-6-[4-methyl-3-(1-pyrrolidinylsulfonyl)phenyl]-3-pyridazinone IUPAC Name: 2-[2-(4-fluorophenoxy)ethyl]-6-(4-methyl-3-pyrrolidin-1-ylsulfonylphenyl)pyridazin-3-one Traditional Name: 2-[2-(4-fluorophenoxy)ethyl]-6-(4-methyl-3-pyrrolidinosulfonyl-phenyl)pyridazin-3-one Formula: C23H24FN3O4S MolecularWeight: 457.517763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CCOC3=CC=C(C=C3)F)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CCOC3=CC=C(C=C3)F)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C23H24FN3O4S/c1-17-4-5-18(16-22(17)32(29,30)26-12-2-3-13-26)21-10-11-23(28)27(25-21)14-15-31-20-8-6-19(24)7-9-20/h4-11,16H,2-3,12-15H2,1H3