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

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)ethanamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-N-[2-(2-thienylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]acetamide CAS Name: 2-(1,3-dioxo-2-isoindolyl)-N-(2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)acetamide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-N-(2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)acetamide Traditional Name: 2-phthalimido-N-[2-(2-thienylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]acetamide Formula: C23H19N3O5S2 MolecularWeight: 481.54406

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NC(=O)CN3C(=O)C4=CC=CC=C4C3=O)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NC(=O)CN3C(=O)C4=CC=CC=C4C3=O)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C23H19N3O5S2/c27-20(14-26-22(28)18-4-1-2-5-19(18)23(26)29)24-17-8-7-15-9-10-25(13-16(15)12-17)33(30,31)21-6-3-11-32-21/h1-8,11-12H,9-10,13-14H2,(H,24,27)