4-(azepan-1-ylsulfonyl)-N-[2-methyl-1,3-bis(oxidanylidene)isoindol-5-yl]benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-[2-methyl-1,3-bis(oxidanylidene)isoindol-5-yl]benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-(2-methyl-1,3-dioxo-isoindolin-5-yl)benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-(2-methyl-1,3-dioxo-5-isoindolyl)benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-(2-methyl-1,3-dioxoisoindol-5-yl)benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-(1,3-diketo-2-methyl-isoindolin-5-yl)benzamide Formula: C22H23N3O5S MolecularWeight: 441.50012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1=O)C=C(C=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CN1C(=O)C2=C(C1=O)C=C(C=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C22H23N3O5S/c1-24-21(27)18-11-8-16(14-19(18)22(24)28)23-20(26)15-6-9-17(10-7-15)31(29,30)25-12-4-2-3-5-13-25/h6-11,14H,2-5,12-13H2,1H3,(H,23,26)