2-[[[1,1-bis(oxidanylidene)thiolan-3-yl]-butyl-amino]methyl]-5,6-bis(chloranyl)isoindole-1,3-dione

Systemtic Name: 2-[[[1,1-bis(oxidanylidene)thiolan-3-yl]-butyl-amino]methyl]-5,6-bis(chloranyl)isoindole-1,3-dione Openeye Name: 2-[[butyl-(1,1-dioxothiolan-3-yl)amino]methyl]-5,6-dichloro-isoindoline-1,3-dione CAS Name: 2-[[butyl-(1,1-dioxo-3-thiolanyl)amino]methyl]-5,6-dichloroisoindole-1,3-dione IUPAC Name: 2-[[butyl-(1,1-dioxothiolan-3-yl)amino]methyl]-5,6-dichloroisoindole-1,3-dione Traditional Name: 2-[[butyl-(1,1-diketothiolan-3-yl)amino]methyl]-5,6-dichloro-isoindoline-1,3-quinone Formula: C17H20Cl2N2O4S MolecularWeight: 419.3227

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20Cl2N2O4S/c1-2-3-5-20(11-4-6-26(24,25)9-11)10-21-16(22)12-7-14(18)15(19)8-13(12)17(21)23/h7-8,11H,2-6,9-10H2,1H3