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5-[(t-Butoxy)carbonyl]-4-methyl-6-[3',4'-dimethoxyphenyl]-3,4-dihydro-1,3-pyrimidine-2-thione
SpectraBase Compound ID 3c8SciRYq1P
InChI InChI=1S/C18H24N2O4S/c1-10-14(16(21)24-18(2,3)4)15(20-17(25)19-10)11-7-8-12(22-5)13(9-11)23-6/h7-9,15H,1-6H3,(H2,19,20,25)
InChIKey RZCVBXUVHNSSHH-UHFFFAOYSA-N
Mol Weight 364.46 g/mol
Molecular Formula C18H24N2O4S
Exact Mass 364.145678 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9Tk1smZXUK1
Name 5-[(T-Butoxy)carbonyl]-4-methyl-6-[3',4'-dimethoxyphenyl]-3,4-dihydro-1,3-pyrimidine-2-thione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 364.145678431 u
Formula C18H24N2O4S
InChI InChI=1S/C18H24N2O4S/c1-10-14(16(21)24-18(2,3)4)15(20-17(25)19-10)11-7-8-12(22-5)13(9-11)23-6/h7-9,15H,1-6H3,(H2,19,20,25)
InChIKey RZCVBXUVHNSSHH-UHFFFAOYSA-N
Molecular Weight 364.460 g/mol
SMILES C=1(C(NC(NC1C)=S)C1=CC(OC)=C(C=C1)OC)C(OC(C)(C)C)=O