1-[1-(3-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-[1-(3-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-ethanone Openeye Name: 1-[1-(3-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-[(5-morpholinosulfonyl-2-pyridyl)sulfanyl]ethanone CAS Name: 1-[1-(3-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]-2-[[5-(4-morpholinylsulfonyl)-2-pyridinyl]thio]ethanone IUPAC Name: 1-[1-(3-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanylethanone Traditional Name: 1-[1-(3-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-[(5-morpholinosulfonyl-2-pyridyl)thio]ethanone Formula: C23H24FN3O4S2 MolecularWeight: 489.582763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC=C2)F)C)C(=O)CSC3=NC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC=C2)F)C)C(=O)CSC3=NC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C23H24FN3O4S2/c1-16-12-21(17(2)27(16)19-5-3-4-18(24)13-19)22(28)15-32-23-7-6-20(14-25-23)33(29,30)26-8-10-31-11-9-26/h3-7,12-14H,8-11,15H2,1-2H3