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4-(5-bromo-2-thienyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid cyclohexyl ester
SpectraBase Compound ID 2plodeJvDie
InChI InChI=1S/C16H19BrN2O3S/c1-9-13(15(20)22-10-5-3-2-4-6-10)14(19-16(21)18-9)11-7-8-12(17)23-11/h7-8,10,14H,2-6H2,1H3,(H2,18,19,21)
InChIKey GRCUFZATWPPITH-UHFFFAOYSA-N
Mol Weight 399.3 g/mol
Molecular Formula C16H19BrN2O3S
Exact Mass 398.029977 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DhesyqiTaLo
Name 4-(5-bromo-2-thienyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid cyclohexyl ester
Alternate Name(s) 4-(5-bromo-2-thiophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid cyclohexyl ester cyclohexyl 4-(5-bromanylthiophen-2-yl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate cyclohexyl 4-(5-bromo-2-thienyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate cyclohexyl 4-(5-bromothiophen-2-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
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Formula C16H19BrN2O3S
InChI InChI=1S/C16H19BrN2O3S/c1-9-13(15(20)22-10-5-3-2-4-6-10)14(19-16(21)18-9)11-7-8-12(17)23-11/h7-8,10,14H,2-6H2,1H3,(H2,18,19,21)
InChIKey GRCUFZATWPPITH-UHFFFAOYSA-N
Molecular Weight 399.303 g/mol
SMILES N1C(NC(=C(C1c1sc(Br)cc1)C(OC1CCCCC1)=O)C)=O
SPLASH splash10-0a4l-9200000000-5a43ecb7c96d431ddce0
Wiley ID 1464688