5-Methyl-6-[(4-nitrobenzyl)thio]-1H-pyrimidin-2-one

SpectraBase Compound ID	lIPK57ld2W
InChI	InChI=1S/C12H11N3O3S/c1-8-6-13-12(16)14-11(8)19-7-9-2-4-10(5-3-9)15(17)18/h2-6H,7H2,1H3,(H,13,14,16)
InChIKey	ATIHKPMWFMZTSF-UHFFFAOYSA-N Google Search
Mol Weight	277.3 g/mol
Molecular Formula	C12H11N3O3S
Exact Mass	277.052112 g/mol

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SpectraBase Spectrum ID	DcWV4wQuKMO
Name	5-Methyl-6-[(4-nitrobenzyl)thio]-1H-pyrimidin-2-one
CAS Registry Number	78932-29-3
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C12H11N3O3S
InChI	InChI=1S/C12H11N3O3S/c1-8-6-13-12(16)14-11(8)19-7-9-2-4-10(5-3-9)15(17)18/h2-6H,7H2,1H3,(H,13,14,16)
InChIKey	ATIHKPMWFMZTSF-UHFFFAOYSA-N
Molecular Weight	277.298 g/mol
SMILES	N1C=C(C(=NC1=O)SCc1ccc(N(=O)=O)cc1)C
SPLASH	splash10-004l-1790000000-3e4cd302ee62c710999c
Source of Spectrum	0-16-155-4
Synonyms	5-Methyl-6-[(4-nitrophenyl)methylsulfanyl]-1H-pyrimidin-2-one 5-Methyl-6-[(4-nitrophenyl)methylthio]-1H-pyrimidin-2-one
Wiley ID	1280803