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2-[(4-amino-6-oxo-1,6-dihydro-2-pyrimidinyl)sulfanyl]-N-(1-phenylethyl)acetamide

View entire compound with spectra: 4 NMR

2-[(4-amino-6-oxo-1,6-dihydro-2-pyrimidinyl)sulfanyl]-N-(1-phenylethyl)acetamide
SpectraBase Compound ID FHS02DXJ9JE
InChI InChI=1S/C14H16N4O2S/c1-9(10-5-3-2-4-6-10)16-13(20)8-21-14-17-11(15)7-12(19)18-14/h2-7,9H,8H2,1H3,(H,16,20)(H3,15,17,18,19)
InChIKey LGACNDIWZZWVRQ-UHFFFAOYSA-N
Mol Weight 304.37 g/mol
Molecular Formula C14H16N4O2S
Exact Mass 304.099397 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4tybJa2RWyf
Name 2-[(4-Amino-6-oxo-1,6-dihydro-2-pyrimidinyl)sulfanyl]-N-(1-phenylethyl)acetamide
Comments Computed using HOSE algorithm
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Exact Mass 304.099396943 u
Formula C14H16N4O2S
InChI InChI=1S/C14H16N4O2S/c1-9(10-5-3-2-4-6-10)16-13(20)8-21-14-17-11(15)7-12(19)18-14/h2-7,9H,8H2,1H3,(H,16,20)(H3,15,17,18,19)
InChIKey LGACNDIWZZWVRQ-UHFFFAOYSA-N
Molecular Weight 304.368 g/mol
SMILES N(C(CSC1=NC(=CC(=O)N1)N)=O)C(C1=CC=CC=C1)C