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2-[(6-amino-4-keto-1-phenethyl-pyrimidin-2-yl)thio]-N-(2-cyanophenyl)butyramide

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2-[(6-amino-4-keto-1-phenethyl-pyrimidin-2-yl)thio]-N-(2-cyanophenyl)butyramide
SpectraBase Compound ID 49iwEOnuMPc
InChI InChI=1S/C23H23N5O2S/c1-2-19(22(30)26-18-11-7-6-10-17(18)15-24)31-23-27-21(29)14-20(25)28(23)13-12-16-8-4-3-5-9-16/h3-11,14,19H,2,12-13,25H2,1H3,(H,26,30)
InChIKey HSLZLFXBKPAEDP-UHFFFAOYSA-N
Mol Weight 433.53 g/mol
Molecular Formula C23H23N5O2S
Exact Mass 433.157246 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JZn0Ka2VNkD
Name 2-[(6-amino-4-keto-1-phenethyl-pyrimidin-2-yl)thio]-N-(2-cyanophenyl)butyramide
Alternate Name(s) 2-[[6-amino-4-oxo-1-(2-phenylethyl)-2-pyrimidinyl]thio]-N-(2-cyanophenyl)butanamide 2-[6-amino-4-oxo-1-(2-phenylethyl)pyrimidin-2-yl]sulfanyl-N-(2-cyanophenyl)butanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H23N5O2S
InChI InChI=1S/C23H23N5O2S/c1-2-19(22(30)26-18-11-7-6-10-17(18)15-24)31-23-27-21(29)14-20(25)28(23)13-12-16-8-4-3-5-9-16/h3-11,14,19H,2,12-13,25H2,1H3,(H,26,30)
InChIKey HSLZLFXBKPAEDP-UHFFFAOYSA-N
Molecular Weight 433.530 g/mol
SMILES NC=1N(C(SC(C(=O)Nc2c(cccc2)C#N)CC)=NC(C1)=O)CCc1ccccc1
SPLASH splash10-00kf-9510000000-98eb2893ec63d452bd10
Wiley ID 1445539