2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)ethanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)ethanamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-N-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)acetamide CAS Name: 2-(1,3-dioxo-2-isoindolyl)-N-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)acetamide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-N-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)acetamide Traditional Name: N-(2-mesyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-phthalimido-acetamide Formula: C20H19N3O5S MolecularWeight: 413.44696

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H19N3O5S/c1-29(27,28)22-9-8-13-6-7-15(10-14(13)11-22)21-18(24)12-23-19(25)16-4-2-3-5-17(16)20(23)26/h2-7,10H,8-9,11-12H2,1H3,(H,21,24)