2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfonyl-N-(2,4,6-trimethylphenyl)butanamide

Systemtic Name: 2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfonyl-N-(2,4,6-trimethylphenyl)butanamide Openeye Name: 2-(5-bromo-1,3-dioxo-isoindolin-2-yl)-4-methylsulfonyl-N-(2,4,6-trimethylphenyl)butanamide CAS Name: 2-(5-bromo-1,3-dioxo-2-isoindolyl)-4-methylsulfonyl-N-(2,4,6-trimethylphenyl)butanamide IUPAC Name: 2-(5-bromo-1,3-dioxoisoindol-2-yl)-4-methylsulfonyl-N-(2,4,6-trimethylphenyl)butanamide Traditional Name: 2-(5-bromo-1,3-diketo-isoindolin-2-yl)-N-mesityl-4-mesyl-butyramide Formula: C22H23BrN2O5S MolecularWeight: 507.39742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C(CCS(=O)(=O)C)N2C(=O)C3=C(C2=O)C=C(C=C3)Br)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C(CCS(=O)(=O)C)N2C(=O)C3=C(C2=O)C=C(C=C3)Br)C

InChI

InChI=1S/C22H23BrN2O5S/c1-12-9-13(2)19(14(3)10-12)24-20(26)18(7-8-31(4,29)30)25-21(27)16-6-5-15(23)11-17(16)22(25)28/h5-6,9-11,18H,7-8H2,1-4H3,(H,24,26)