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2-(6-amino-4-oxo-1-phenethylpyrimidin-2-yl)sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)butanamide
SpectraBase Compound ID 6R8FdDK6m0J
InChI InChI=1S/C20H23N5O3S/c1-3-15(19(27)22-17-11-13(2)28-24-17)29-20-23-18(26)12-16(21)25(20)10-9-14-7-5-4-6-8-14/h4-8,11-12,15H,3,9-10,21H2,1-2H3,(H,22,24,27)
InChIKey LXSULZYFVVWBSF-UHFFFAOYSA-N
Mol Weight 413.5 g/mol
Molecular Formula C20H23N5O3S
Exact Mass 413.152161 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JmParPsIVcz
Name 2-(6-amino-4-oxo-1-phenethylpyrimidin-2-yl)sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)butanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23N5O3S
InChI InChI=1S/C20H23N5O3S/c1-3-15(19(27)22-17-11-13(2)28-24-17)29-20-23-18(26)12-16(21)25(20)10-9-14-7-5-4-6-8-14/h4-8,11-12,15H,3,9-10,21H2,1-2H3,(H,22,24,27)
InChIKey LXSULZYFVVWBSF-UHFFFAOYSA-N
Molecular Weight 413.496 g/mol
SMILES NC=1N(C(SC(C(Nc2cc(on2)C)=O)CC)=NC(C1)=O)CCc1ccccc1
SPLASH splash10-052f-9300000000-0dbe606f3f7d6e4c58dc
Synonyms 2-[(6-amino-4-keto-1-phenethyl-pyrimidin-2-yl)thio]-N-(5-methylisoxazol-3-yl)butyramide 2-[[6-amino-4-oxo-1-(2-phenylethyl)-2-pyrimidinyl]thio]-N-(5-methyl-3-isoxazolyl)butanamide 2-[6-amino-4-oxo-1-(2-phenylethyl)pyrimidin-2-yl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)butanamide 2-[6-amino-4-oxo-1-(2-phenylethyl)pyrimidin-2-yl]sulfanyl-N-(5-methylisoxazol-3-yl)butanamide
Wiley ID 1445526