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2-[(6-amino-4-keto-1-phenethyl-pyrimidin-2-yl)thio]-N-benzyl-acetamide
SpectraBase Compound ID 1R6ngQKxDVg
InChI InChI=1S/C21H22N4O2S/c22-18-13-19(26)24-21(25(18)12-11-16-7-3-1-4-8-16)28-15-20(27)23-14-17-9-5-2-6-10-17/h1-10,13H,11-12,14-15,22H2,(H,23,27)
InChIKey URPBTRTWVLHFMB-UHFFFAOYSA-N
Mol Weight 394.49 g/mol
Molecular Formula C21H22N4O2S
Exact Mass 394.146347 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J6uxOBFtGwS
Name 2-[(6-amino-4-keto-1-phenethyl-pyrimidin-2-yl)thio]-N-benzyl-acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22N4O2S
InChI InChI=1S/C21H22N4O2S/c22-18-13-19(26)24-21(25(18)12-11-16-7-3-1-4-8-16)28-15-20(27)23-14-17-9-5-2-6-10-17/h1-10,13H,11-12,14-15,22H2,(H,23,27)
InChIKey URPBTRTWVLHFMB-UHFFFAOYSA-N
Molecular Weight 394.493 g/mol
SMILES NC1=CC(N=C(SCC(NCc2ccccc2)=O)N1CCc1ccccc1)=O
SPLASH splash10-0f6x-9700000000-ac33174c8e22ddfcd5e8
Synonyms Acetamide, 2-(6-amino-4-oxo-1-phenethyl-1,4-dihydropyrimidin-2-ylsulfanyl)-N-benzyl- 2-[[6-amino-4-oxo-1-(2-phenylethyl)-2-pyrimidinyl]thio]-N-(phenylmethyl)acetamide 2-[6-amino-4-oxo-1-(2-phenylethyl)pyrimidin-2-yl]sulfanyl-N-benzylacetamide 2-[6-amino-4-oxo-1-(2-phenylethyl)pyrimidin-2-yl]sulfanyl-N-benzyl-acetamide
Wiley ID 1438233