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2-[(6-ethyl-4-thieno[2,3-d]pyrimidinyl)amino]-4-(methylthio)butanoic acid
SpectraBase Compound ID JCv1OQAhjtg
InChI InChI=1S/C13H17N3O2S2/c1-3-8-6-9-11(14-7-15-12(9)20-8)16-10(13(17)18)4-5-19-2/h6-7,10H,3-5H2,1-2H3,(H,17,18)(H,14,15,16)
InChIKey OUKMDYCZGUXJDV-UHFFFAOYSA-N
Mol Weight 311.42 g/mol
Molecular Formula C13H17N3O2S2
Exact Mass 311.076219 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8x9nTtY10M2
Name 2-[(6-ethyl-4-thieno[2,3-d]pyrimidinyl)amino]-4-(methylthio)butanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17N3O2S2
InChI InChI=1S/C13H17N3O2S2/c1-3-8-6-9-11(14-7-15-12(9)20-8)16-10(13(17)18)4-5-19-2/h6-7,10H,3-5H2,1-2H3,(H,17,18)(H,14,15,16)
InChIKey OUKMDYCZGUXJDV-UHFFFAOYSA-N
Molecular Weight 311.418 g/mol
SMILES N(C(C(O)=O)CCSC)c1c2c(ncn1)sc(c2)CC
SPLASH splash10-03dl-5970000000-3e73b6014af850d4e776
Synonyms 2-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]-4-(methylthio)butyric acid 2-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]-4-methylsulfanyl-butanoic acid
Wiley ID 1452143