CHEBI:93590 - 2-[[4-(5-chloro-2-propoxyanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]ethanol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-[[4-(5-chloro-2-propoxyanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]ethanol
ChEBI ID CHEBI:93590
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C18H25ClN6O2
Net Charge 0
Average Mass 392.884
Monoisotopic Mass 392.17275
InChI InChI=1S/C18H25ClN6O2/c1-2-11-27-15-6-5-13(19)12-14(15)21-17-22-16(20-7-10-26)23-18(24-17)25-8-3-4-9-25/h5-6,12,26H,2-4,7-11H2,1H3,(H2,20,21,22,23,24)
InChIKey NXEKZBMPMPBIGJ-UHFFFAOYSA-N
SMILES CCCOC1=C(C=C(C=C1)Cl)NC2=NC(=NC(=N2)N3CCCC3)NCCO
ChEBI Ontology
Outgoing 2-[[4-(5-chloro-2-propoxyanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]ethanol (CHEBI:93590) is a aromatic ether (CHEBI:35618)
Manual Xref Database
LSM-4040 LINCS
View more database links