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CHEBI:233451 - (1R,2S)-suloctidil

ChEBI IDCHEBI:233451
ChEBI Name(1R,2S)-suloctidil
Stars
ASCII Name(1R,2S)-suloctidil
DefinitionA suloctidil that has (1R,2S)-configuration.
Last Modified5 February 2025
SubmitterAdnan
DownloadsMolfile
FormulaC20H35NOS
Net Charge0
Average Mass337.573
Monoisotopic Mass337.24394
SMILESCCCCCCCCN[C@@H](C)[C@H](O)c1ccc(SC(C)C)cc1
InChIInChI=1S/C20H35NOS/c1-5-6-7-8-9-10-15-21-17(4)20(22)18-11-13-19(14-12-18)23-16(2)3/h11-14,16-17,20-22H,5-10,15H2,1-4H3/t17-,20-/m0/s1
InChIKeyBFCDFTHTSVTWOG-PXNSSMCTSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
(1R,2S)-suloctidil (CHEBI:233451) is a suloctidil (CHEBI:91639)
Incoming Relation(s)
(±)-suloctidil (CHEBI:233445) has part (1R,2S)-suloctidil (CHEBI:233451)
IUPAC Name 
(1R,2S)-2-(octylamino)-1-[4-(propan-2-ylsulfanyl)phenyl]propan-1-ol
Synonyms  Source
(1R,2S)-2-(octylamino)-1-[4-(propan-2-ylthio)phenyl]propan-1-olIUPAC
(αR)-α-[(S)-1-(octylamino)ethyl]-4-[(1-methylethyl)thio]benzenemethanolChEBI
(1R,2S)-2-(octylamino)-1-[4-(propan-2-ylthio)phenyl]propan-1-olChEBI