2-[[(2S)-1-ethylsulfonylpyrrolidin-2-yl]methyl]-6-(4-fluorophenyl)pyridazin-3-one

Systemtic Name: 2-[[(2S)-1-ethylsulfonylpyrrolidin-2-yl]methyl]-6-(4-fluorophenyl)pyridazin-3-one Openeye Name: 2-[[(2S)-1-ethylsulfonylpyrrolidin-2-yl]methyl]-6-(4-fluorophenyl)pyridazin-3-one CAS Name: 2-[[(2S)-1-ethylsulfonyl-2-pyrrolidinyl]methyl]-6-(4-fluorophenyl)-3-pyridazinone IUPAC Name: 2-[[(2S)-1-ethylsulfonylpyrrolidin-2-yl]methyl]-6-(4-fluorophenyl)pyridazin-3-one Traditional Name: 2-[[(2S)-1-esylpyrrolidin-2-yl]methyl]-6-(4-fluorophenyl)pyridazin-3-one Formula: C17H20FN3O3S MolecularWeight: 365.422403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCCC1CN2C(=O)C=CC(=N2)C3=CC=C(C=C3)F

Isomeric SMILES

CCS(=O)(=O)N1CCC[C@H]1CN2C(=O)C=CC(=N2)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H20FN3O3S/c1-2-25(23,24)21-11-3-4-15(21)12-20-17(22)10-9-16(19-20)13-5-7-14(18)8-6-13/h5-10,15H,2-4,11-12H2,1H3/t15-/m0/s1