1-[[[1,1-bis(oxidanylidene)thiolan-3-yl]-butyl-amino]methyl]-4-bromanyl-indole-2,3-dione

Systemtic Name: 1-[[[1,1-bis(oxidanylidene)thiolan-3-yl]-butyl-amino]methyl]-4-bromanyl-indole-2,3-dione Openeye Name: 4-bromo-1-[[butyl-(1,1-dioxothiolan-3-yl)amino]methyl]indoline-2,3-dione CAS Name: 4-bromo-1-[[butyl-(1,1-dioxo-3-thiolanyl)amino]methyl]indole-2,3-dione IUPAC Name: 4-bromo-1-[[butyl-(1,1-dioxothiolan-3-yl)amino]methyl]indole-2,3-dione Traditional Name: 4-bromo-1-[[butyl-(1,1-diketothiolan-3-yl)amino]methyl]isatin Formula: C17H21BrN2O4S MolecularWeight: 429.32864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CN1C2=C(C(=CC=C2)Br)C(=O)C1=O)C3CCS(=O)(=O)C3

Isomeric SMILES

CCCCN(CN1C2=C(C(=CC=C2)Br)C(=O)C1=O)C3CCS(=O)(=O)C3

InChI

InChI=1S/C17H21BrN2O4S/c1-2-3-8-19(12-7-9-25(23,24)10-12)11-20-14-6-4-5-13(18)15(14)16(21)17(20)22/h4-6,12H,2-3,7-11H2,1H3