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N-(4-butoxybenzoyl)-N'-(2-methyl-5-[1,3]oxazolo[4,5-b]pyridin-2-ylphenyl)thiourea

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N-(4-butoxybenzoyl)-N'-(2-methyl-5-[1,3]oxazolo[4,5-b]pyridin-2-ylphenyl)thiourea
SpectraBase Compound ID G6qNG8GnYrE
InChI InChI=1S/C25H24N4O3S/c1-3-4-14-31-19-11-9-17(10-12-19)23(30)29-25(33)27-20-15-18(8-7-16(20)2)24-28-22-21(32-24)6-5-13-26-22/h5-13,15H,3-4,14H2,1-2H3,(H2,27,29,30,33)
InChIKey URAVESZYSNKCLR-UHFFFAOYSA-N
Mol Weight 460.55 g/mol
Molecular Formula C25H24N4O3S
Exact Mass 460.156912 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8RJDMn9y5PB
Name N-(4-Butoxybenzoyl)-N'-(2-methyl-5-[1,3]oxazolo[4,5-B]pyridin-2-ylphenyl)thiourea
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 460.156911820 u
Formula C25H24N4O3S
InChI InChI=1S/C25H24N4O3S/c1-3-4-14-31-19-11-9-17(10-12-19)23(30)29-25(33)27-20-15-18(8-7-16(20)2)24-28-22-21(32-24)6-5-13-26-22/h5-13,15H,3-4,14H2,1-2H3,(H2,27,29,30,33)
InChIKey URAVESZYSNKCLR-UHFFFAOYSA-N
Molecular Weight 460.552 g/mol
SMILES N(C(NC=1C=C(C2=NC3=C(C=CC=N3)O2)C=CC1C)=S)C(C1=CC=C(C=C1)OCCCC)=O