CHEBI:104912 - 2-[[6-[(5-chloro-2,4-dimethoxyanilino)-oxomethyl]-1,2,3,4-tetrahydroacridin-9-yl]thio]acetic acid

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ChEBI Name 2-[[6-[(5-chloro-2,4-dimethoxyanilino)-oxomethyl]-1,2,3,4-tetrahydroacridin-9-yl]thio]acetic acid
ChEBI ID CHEBI:104912
Stars This entity has been manually annotated by a third party.
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Formula C24H23ClN2O5S
Net Charge 0
Average Mass 486.970
Monoisotopic Mass 486.10162
InChI InChI=1S/C24H23ClN2O5S/c1-31-20-11-21(32-2)19(10-16(20)25)27-24(30)13-7-8-15-18(9-13)26-17-6-4-3-5-14(17)23(15)33-12-22(28)29/h7-11H,3-6,12H2,1-2H3,(H,27,30)(H,28,29)
InChIKey FPIJGQYIKXQHHG-UHFFFAOYSA-N
SMILES COC1=CC(=C(C=C1NC(=O)C2=CC3=C(C=C2)C(=C4CCCCC4=N3)SCC(=O)O)Cl)OC
ChEBI Ontology
Outgoing 2-[[6-[(5-chloro-2,4-dimethoxyanilino)-oxomethyl]-1,2,3,4-tetrahydroacridin-9-yl]thio]acetic acid (CHEBI:104912) is a acridines (CHEBI:22213)
Manual Xref Database
LSM-16275 LINCS
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