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allyl (2Z)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

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allyl (2Z)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SpectraBase Compound ID 3mq3UWJDRR0
InChI InChI=1S/C26H24N2O5S/c1-5-14-33-25(30)21-16(2)27-26-28(22(21)17-10-7-6-8-11-17)24(29)20(34-26)15-18-12-9-13-19(31-3)23(18)32-4/h5-13,15,22H,1,14H2,2-4H3/b20-15-
InChIKey BWJAMXIUFOKUKG-HKWRFOASSA-N
Mol Weight 476.55 g/mol
Molecular Formula C26H24N2O5S
Exact Mass 476.140593 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 40CS0SxESS6
Name Allyl (2Z)-2-(2,3-dimethoxybenzylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-A]pyrimidine-6-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 476.140593050 u
Formula C26H24N2O5S
InChI InChI=1S/C26H24N2O5S/c1-5-14-33-25(30)21-16(2)27-26-28(22(21)17-10-7-6-8-11-17)24(29)20(34-26)15-18-12-9-13-19(31-3)23(18)32-4/h5-13,15,22H,1,14H2,2-4H3/b20-15-
InChIKey BWJAMXIUFOKUKG-HKWRFOASSA-N
Molecular Weight 476.547 g/mol
SMILES C1=CC=C(C2C(=C(C)N=C3N2C(\C(=C\C=2C(=C(OC)C=CC2)OC)S3)=O)C(=O)OCC=C)C=C1