N-[[2-[2,6-bis(oxidanylidene)piperidin-3-yl]-1-oxidanylidene-3H-isoindol-5-yl]methyl]-4-methylsulfonyl-benzamide

Systemtic Name: N-[[2-[2,6-bis(oxidanylidene)piperidin-3-yl]-1-oxidanylidene-3H-isoindol-5-yl]methyl]-4-methylsulfonyl-benzamide Openeye Name: N-[[2-(2,6-dioxo-3-piperidyl)-1-oxo-isoindolin-5-yl]methyl]-4-methylsulfonyl-benzamide CAS Name: N-[[2-(2,6-dioxo-3-piperidinyl)-1-oxo-3H-isoindol-5-yl]methyl]-4-methylsulfonylbenzamide IUPAC Name: N-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]methyl]-4-methylsulfonylbenzamide Traditional Name: N-[[2-(2,6-diketo-3-piperidyl)-1-keto-isoindolin-5-yl]methyl]-4-mesyl-benzamide Formula: C22H21N3O6S MolecularWeight: 455.48364

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NCC2=CC3=C(C=C2)C(=O)N(C3)C4CCC(=O)NC4=O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NCC2=CC3=C(C=C2)C(=O)N(C3)C4CCC(=O)NC4=O

InChI

InChI=1S/C22H21N3O6S/c1-32(30,31)16-5-3-14(4-6-16)20(27)23-11-13-2-7-17-15(10-13)12-25(22(17)29)18-8-9-19(26)24-21(18)28/h2-7,10,18H,8-9,11-12H2,1H3,(H,23,27)(H,24,26,28)