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CHEBI:114239 - 3-[(2-chlorophenyl)methyl]-5-[1-(1-oxo-2-thiophen-2-ylethyl)-4-piperidinyl]-2H-triazolo[4,5-d]pyrimidin-7-one

ChEBI IDCHEBI:114239
ChEBI Name3-[(2-chlorophenyl)methyl]-5-[1-(1-oxo-2-thiophen-2-ylethyl)-4-piperidinyl]-2H-triazolo[4,5-d]pyrimidin-7-one
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DownloadsMolfile
FormulaC22H21ClN6O2S
Net Charge0
Average Mass468.970
Monoisotopic Mass468.11352
SMILESO=C(Cc1cccs1)N1CCC(c2nc3n(Cc4ccccc4Cl)nnc-3c(=O)n2)CC1
InChIInChI=1S/C22H21ClN6O2S/c23-17-6-2-1-4-15(17)13-29-21-19(26-27-29)22(31)25-20(24-21)14-7-9-28(10-8-14)18(30)12-16-5-3-11-32-16/h1-6,11,14,27H,7-10,12-13H2
InChIKeyIUKGPINHGYNINN-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-[(2-chlorophenyl)methyl]-5-[1-(1-oxo-2-thiophen-2-ylethyl)-4-piperidinyl]-2H-triazolo[4,5-d]pyrimidin-7-one (CHEBI:114239) is a triazolopyrimidines (CHEBI:48435)
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LSM-25700LINCS