CHEBI:105953 - 1-(5-chloro-2-methoxyphenyl)-2-[(4,6-diamino-2-pyrimidinyl)thio]ethanone

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ChEBI Name 1-(5-chloro-2-methoxyphenyl)-2-[(4,6-diamino-2-pyrimidinyl)thio]ethanone
ChEBI ID CHEBI:105953
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C13H13ClN4O2S
Net Charge 0
Average Mass 324.787
Monoisotopic Mass 324.04477
InChI InChI=1S/C13H13ClN4O2S/c1-20-10-3-2-7(14)4-8(10)9(19)6-21-13-17-11(15)5-12(16)18-13/h2-5H,6H2,1H3,(H4,15,16,17,18)
InChIKey RGGRTIAUGLTXOS-UHFFFAOYSA-N
SMILES COC1=C(C=C(C=C1)Cl)C(=O)CSC2=NC(=CC(=N2)N)N
ChEBI Ontology
Outgoing 1-(5-chloro-2-methoxyphenyl)-2-[(4,6-diamino-2-pyrimidinyl)thio]ethanone (CHEBI:105953) is a aromatic ketone (CHEBI:76224)
Manual Xref Database
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