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CHEBI:752844 - nebentan

Default Structure
ChEBI IDCHEBI:752844
ChEBI Namenebentan
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC24H21N5O5S
Net Charge0
Average Mass491.529
Monoisotopic Mass491.12634
SMILESCOc1ccccc1Oc1c(NS(=O)(=O)/C=C/c2ccccc2)nc(-c2ncccn2)nc1OC
InChIInChI=1S/C24H21N5O5S/c1-32-18-11-6-7-12-19(18)34-20-21(29-35(30,31)16-13-17-9-4-3-5-10-17)27-23(28-24(20)33-2)22-25-14-8-15-26-22/h3-16H,1-2H3,(H,27,28,29)/b16-13+
InChIKeyLONWRQOYFPYMQD-DTQAZKPQSA-N
Roles Classification
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
nebentan (CHEBI:752844) has role antineoplastic agent (CHEBI:35610)
nebentan (CHEBI:752844) is a aromatic ether (CHEBI:35618)
INN  Source
nebentanWHO MedNet
Synonyms  Source
HE-11ChEMBL
Nebentan potassiumChEMBL
Ym598ChEMBL
YM-598ChEMBL