2-[[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-butyl-amino]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-butyl-amino]methyl]isoindole-1,3-dione Openeye Name: 2-[[butyl-[(3S)-1,1-dioxothiolan-3-yl]amino]methyl]isoindoline-1,3-dione CAS Name: 2-[[butyl-[(3S)-1,1-dioxo-3-thiolanyl]amino]methyl]isoindole-1,3-dione IUPAC Name: 2-[[butyl-[(3S)-1,1-dioxothiolan-3-yl]amino]methyl]isoindole-1,3-dione Traditional Name: 2-[[butyl-[(3S)-1,1-diketothiolan-3-yl]amino]methyl]isoindoline-1,3-quinone Formula: C17H22N2O4S MolecularWeight: 350.43258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CN1C(=O)C2=CC=CC=C2C1=O)C3CCS(=O)(=O)C3

Isomeric SMILES

CCCCN(CN1C(=O)C2=CC=CC=C2C1=O)[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C17H22N2O4S/c1-2-3-9-18(13-8-10-24(22,23)11-13)12-19-16(20)14-6-4-5-7-15(14)17(19)21/h4-7,13H,2-3,8-12H2,1H3/t13-/m0/s1