CHEBI:112761 - 5-[(5-acetyl-2-propan-2-yloxyphenyl)methyl]-6-hydroxy-2-sulfanylidene-1H-pyrimidin-4-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5-[(5-acetyl-2-propan-2-yloxyphenyl)methyl]-6-hydroxy-2-sulfanylidene-1H-pyrimidin-4-one
ChEBI ID CHEBI:112761
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C16H18N2O4S
Net Charge 0
Average Mass 334.392
Monoisotopic Mass 334.09873
InChI InChI=1S/C16H18N2O4S/c1-8(2)22-13-5-4-10(9(3)19)6-11(13)7-12-14(20)17-16(23)18-15(12)21/h4-6,8H,7H2,1-3H3,(H3,17,18,20,21,23)
InChIKey DCIDOXBJPJVTFZ-UHFFFAOYSA-N
SMILES CC(C)OC1=C(C=C(C=C1)C(=O)C)CC2=C(NC(=S)NC2=O)O
ChEBI Ontology
Outgoing 5-[(5-acetyl-2-propan-2-yloxyphenyl)methyl]-6-hydroxy-2-sulfanylidene-1H-pyrimidin-4-one (CHEBI:112761) is a aromatic ketone (CHEBI:76224)
Manual Xref Database
LSM-24171 LINCS
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