N-[1,3-bis(oxidanylidene)isoindol-4-yl]-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-[1,3-bis(oxidanylidene)isoindol-4-yl]-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide Openeye Name: N-(1,3-dioxoisoindolin-4-yl)-1-(2-thienylsulfonyl)piperidine-2-carboxamide CAS Name: N-(1,3-dioxo-4-isoindolyl)-1-thiophen-2-ylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-(1,3-dioxoisoindol-4-yl)-1-thiophen-2-ylsulfonylpiperidine-2-carboxamide Traditional Name: N-(1,3-diketoisoindolin-4-yl)-1-(2-thienylsulfonyl)pipecolinamide Formula: C18H17N3O5S2 MolecularWeight: 419.47468

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NC2=CC=CC3=C2C(=O)NC3=O)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CCN(C(C1)C(=O)NC2=CC=CC3=C2C(=O)NC3=O)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C18H17N3O5S2/c22-16-11-5-3-6-12(15(11)18(24)20-16)19-17(23)13-7-1-2-9-21(13)28(25,26)14-8-4-10-27-14/h3-6,8,10,13H,1-2,7,9H2,(H,19,23)(H,20,22,24)