N-(5-acetamido-2-fluoranyl-phenyl)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfonyl-butanamide

Systemtic Name: N-(5-acetamido-2-fluoranyl-phenyl)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfonyl-butanamide Openeye Name: N-(5-acetamido-2-fluoro-phenyl)-2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfonyl-butanamide CAS Name: N-(5-acetamido-2-fluorophenyl)-2-(1,3-dioxo-2-isoindolyl)-4-methylsulfonylbutanamide IUPAC Name: N-(5-acetamido-2-fluorophenyl)-2-(1,3-dioxoisoindol-2-yl)-4-methylsulfonylbutanamide Traditional Name: N-(5-acetamido-2-fluoro-phenyl)-4-mesyl-2-phthalimido-butyramide Formula: C21H20FN3O6S MolecularWeight: 461.463403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)F)NC(=O)C(CCS(=O)(=O)C)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)F)NC(=O)C(CCS(=O)(=O)C)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H20FN3O6S/c1-12(26)23-13-7-8-16(22)17(11-13)24-19(27)18(9-10-32(2,30)31)25-20(28)14-5-3-4-6-15(14)21(25)29/h3-8,11,18H,9-10H2,1-2H3,(H,23,26)(H,24,27)