CHEBI:34523 - Acotiamide

ChEBI IDCHEBI:34523
ChEBI NameAcotiamide
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Last Modified22 February 2017
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FormulaC21H30N4O5S
Net Charge0
Average Mass450.561
Monoisotopic Mass450.19369
SMILESCOc1cc(O)c(C(=O)Nc2nc(C(=O)NCCN(C(C)C)C(C)C)cs2)cc1OC
InChIInChI=1S/C21H30N4O5S/c1-12(2)25(13(3)4)8-7-22-20(28)15-11-31-21(23-15)24-19(27)14-9-17(29-5)18(30-6)10-16(14)26/h9-13,26H,7-8H2,1-6H3,(H,22,28)(H,23,24,27)
InChIKeyTWHZNAUBXFZMCA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Acotiamide (CHEBI:34523) is a salicylamides (CHEBI:53443)
Synonyms  Source
AcotiamideKEGG COMPOUND
MZ-338KEGG COMPOUND
acotiamide HClDrugCentral
Z-338DrugCentral
acotiamide hydrochloride hydrateDrugCentral
acofideDrugCentral
Manual XrefsDatabases
C14127KEGG COMPOUND
4908DrugCentral
Registry NumbersSources
CAS:185106-16-5KEGG COMPOUND