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6-Methyl-4-(4-methyl-3-nitro-phenyl)-2-oxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid 2-ethylsulfanyl-ethyl ester
SpectraBase Compound ID 96bts3wLzOl
InChI InChI=1S/C17H21N3O5S/c1-4-26-8-7-25-16(21)14-11(3)18-17(22)19-15(14)12-6-5-10(2)13(9-12)20(23)24/h5-6,9,15H,4,7-8H2,1-3H3,(H2,18,19,22)
InChIKey UZRQWJWZDFZFHG-UHFFFAOYSA-N
Mol Weight 379.43 g/mol
Molecular Formula C17H21N3O5S
Exact Mass 379.120192 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID aKxr2yFQO
Name 6-Methyl-4-(4-methyl-3-nitro-phenyl)-2-oxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid 2-ethylsulfanyl-ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21N3O5S
InChI InChI=1S/C17H21N3O5S/c1-4-26-8-7-25-16(21)14-11(3)18-17(22)19-15(14)12-6-5-10(2)13(9-12)20(23)24/h5-6,9,15H,4,7-8H2,1-3H3,(H2,18,19,22)
InChIKey UZRQWJWZDFZFHG-UHFFFAOYSA-N
Molecular Weight 379.431 g/mol
SMILES N1C(NC(=C(C1c1cc(N(=O)=O)c(cc1)C)C(=O)OCCSCC)C)=O
SPLASH splash10-01p9-9100000000-470c2666feac989f9456
Synonyms 2-(Ethylsulfanyl)ethyl 6-methyl-4-(4-methyl-3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate 2-Ethylsulfanylethyl 6-methyl-4-(4-methyl-3-nitro-phenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate 2-Ethylsulfanylethyl 6-methyl-4-(4-methyl-3-nitro-phenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate 2-keto-6-methyl-4-(4-methyl-3-nitro-phenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-(ethylthio)ethyl ester 6-Methyl-4-(4-methyl-3-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-(ethylthio)ethyl ester
Wiley ID 1464690