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CHEBI:747991 - chs-828

Default Structure
ChEBI IDCHEBI:747991
ChEBI Namechs-828
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC19H22ClN5O
Net Charge0
Average Mass371.872
Monoisotopic Mass371.15129
SMILESN#CN=C(NCCCCCCOc1ccc(Cl)cc1)Nc1ccncc1
InChIInChI=1S/C19H22ClN5O/c20-16-5-7-18(8-6-16)26-14-4-2-1-3-11-23-19(24-15-21)25-17-9-12-22-13-10-17/h5-10,12-13H,1-4,11,14H2,(H2,22,23,24,25)
InChIKeyBOIPLTNGIAPDBY-UHFFFAOYSA-N
Roles Classification
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
chs-828 (CHEBI:747991) has role antineoplastic agent (CHEBI:35610)
chs-828 (CHEBI:747991) is a aromatic ether (CHEBI:35618)
Synonyms  Source
Chs-828ChEMBL
CHS 828ChEMBL
CHS828ChEMBL
GMX 1778ChEMBL
GMX-1778ChEMBL
GMX1778ChEMBL
Citations