CHEBI:100461 - 5-chlorospiro[indole-3,2'-[1,3]oxathiolan]-2(1H)-one

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ChEBI Name 5-chlorospiro[indole-3,2'-[1,3]oxathiolan]-2(1H)-one ChEBI ID CHEBI:100461 ChEBI ASCII Name 5-chlorospiro[indole-3,2'-[1,3]oxathiolan]-2(1H)-one Definition A monothioketal formed from 5-chloro-1H-indole-2,3-dione. It has been studied for its anticonvulsant properties. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C10H8ClNO2S Net Charge 0 Average Mass 241.69400 Monoisotopic Mass 240.99643 InChI InChI=1S/C10H8ClNO2S/c11-6-1-2-8-7(5-6)10(9(13)12-8)14-3-4-15-10/h1-2,5H,3-4H2,(H,12,13) InChIKey WLGQOYSRXRIQBG-UHFFFAOYSA-N SMILES Clc1ccc2NC(=O)C3(OCCS3)c2c1 Roles Classification Application(s): anticonvulsant A drug used to prevent seizures or reduce their severity. View more via ChEBI Ontology ChEBI Ontology Outgoing 5-chlorospiro[indole-3,2'-[1,3]oxathiolan]-2(1H)-one (CHEBI:100461) has role anticonvulsant (CHEBI:35623) 5-chlorospiro[indole-3,2'-[1,3]oxathiolan]-2(1H)-one (CHEBI:100461) is a monothioketal (CHEBI:59799) 5-chlorospiro[indole-3,2'-[1,3]oxathiolan]-2(1H)-one (CHEBI:100461) is a oxathiolane (CHEBI:78801) IUPAC Name 5-chlorospiro[indole-3,2'-[1,3]oxathiolan]-2(1H)-one Synonym Source 5-chlorospiro[2,3-dihydro-1H-indole-3,2'-(dihydro[1,3]oxathiolane)]-2-one ChEMBL Registry Number Type Source 7094661 Beilstein Registry Number Beilstein Citation Type Source 3361568 PubMed citation ChEMBL Last Modified 11 June 2014