CHEBI:40152 - 1-(ethoxymethyl)-5-isopropyl-6-(phenylsulfanyl)uracil

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-(ethoxymethyl)-5-isopropyl-6-(phenylsulfanyl)uracil
ChEBI ID CHEBI:40152
Definition A pyrimidone that is uracil in which positions 1, 5, and 6 are substituted by ethoxymethyl, isopropyl, and phenylsulfanyl groups, respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C16H20N2O3S
Net Charge 0
Average Mass 320.40700
Monoisotopic Mass 320.11946
InChI InChI=1S/C16H20N2O3S/c1-4-21-10-18-15(22-12-8-6-5-7-9-12)13(11(2)3)14(19)17-16(18)20/h5-9,11H,4,10H2,1-3H3,(H,17,19,20)
InChIKey SFVSRXRSAJNPAC-UHFFFAOYSA-N
SMILES CCOCn1c(Sc2ccccc2)c(C(C)C)c(=O)[nH]c1=O
ChEBI Ontology
Outgoing 1-(ethoxymethyl)-5-isopropyl-6-(phenylsulfanyl)uracil (CHEBI:40152) has functional parent uracil (CHEBI:17568)
1-(ethoxymethyl)-5-isopropyl-6-(phenylsulfanyl)uracil (CHEBI:40152) is a aryl sulfide (CHEBI:35683)
1-(ethoxymethyl)-5-isopropyl-6-(phenylsulfanyl)uracil (CHEBI:40152) is a pyrimidone (CHEBI:38337)
IUPAC Name
1-(ethoxymethyl)-6-(phenylsulfanyl)-5-(propan-2-yl)pyrimidine-2,4(1H,3H)-dione
Synonyms Sources
5-isopropyl-1-(ethoxymethyl)-6-(phenylthio)uracil ChEBI
5-isopropyl-1-ethoxymethyl-6-(phenylthio)uracil ChemIDplus
Registry Numbers Types Sources
136160-32-2 CAS Registry Number ChemIDplus
5880800 Reaxys Registry Number Reaxys
Last Modified
12 August 2011