2-acetamido-N-[2-bromanyl-4,6-bis(fluoranyl)phenyl]-4-methylsulfonyl-butanamide

Systemtic Name: 2-acetamido-N-[2-bromanyl-4,6-bis(fluoranyl)phenyl]-4-methylsulfonyl-butanamide Openeye Name: 2-acetamido-N-(2-bromo-4,6-difluoro-phenyl)-4-methylsulfonyl-butanamide CAS Name: 2-acetamido-N-(2-bromo-4,6-difluorophenyl)-4-methylsulfonylbutanamide IUPAC Name: 2-acetamido-N-(2-bromo-4,6-difluorophenyl)-4-methylsulfonylbutanamide Traditional Name: 2-acetamido-N-(2-bromo-4,6-difluoro-phenyl)-4-mesyl-butyramide Formula: C13H15BrF2N2O4S MolecularWeight: 413.235006

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCS(=O)(=O)C)C(=O)NC1=C(C=C(C=C1Br)F)F

Isomeric SMILES

CC(=O)NC(CCS(=O)(=O)C)C(=O)NC1=C(C=C(C=C1Br)F)F

InChI

InChI=1S/C13H15BrF2N2O4S/c1-7(19)17-11(3-4-23(2,21)22)13(20)18-12-9(14)5-8(15)6-10(12)16/h5-6,11H,3-4H2,1-2H3,(H,17,19)(H,18,20)