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Ethyl 4-(2,4-dimethoxyphenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate

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Ethyl 4-(2,4-dimethoxyphenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
SpectraBase Compound ID CM6Hvs3wYIM
InChI InChI=1S/C16H20N2O4S/c1-5-22-15(19)13-9(2)17-16(23)18-14(13)11-7-6-10(20-3)8-12(11)21-4/h6-8,14H,5H2,1-4H3,(H2,17,18,23)
InChIKey SFEZJEYGQBEENZ-UHFFFAOYSA-N
Mol Weight 336.41 g/mol
Molecular Formula C16H20N2O4S
Exact Mass 336.114378 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4ZqyAvMHMX5
Name Ethyl 4-(2,4-dimethoxyphenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 336.114378302 u
Formula C16H20N2O4S
InChI InChI=1S/C16H20N2O4S/c1-5-22-15(19)13-9(2)17-16(23)18-14(13)11-7-6-10(20-3)8-12(11)21-4/h6-8,14H,5H2,1-4H3,(H2,17,18,23)
InChIKey SFEZJEYGQBEENZ-UHFFFAOYSA-N
Molecular Weight 336.406 g/mol
SMILES C1(=C(C=C(C=C1)OC)OC)C1NC(=S)NC(=C1C(OCC)=O)C