SpectraBase Spectrum ID |
L1CSytf71c9 |
Name |
Thiourea, N-(5-chloro-2-methoxybenzoyl)-N'-(2-methyl-5-oxazolo[4,5-B]pyridin-2-ylphenyl)- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
452.070989294 u |
Formula |
C22H17ClN4O3S |
InChI |
InChI=1S/C22H17ClN4O3S/c1-12-5-6-13(21-26-19-18(30-21)4-3-9-24-19)10-16(12)25-22(31)27-20(28)15-11-14(23)7-8-17(15)29-2/h3-11H,1-2H3,(H2,25,27,28,31) |
InChIKey |
CWXYXKIDMPKQER-UHFFFAOYSA-N |
Molecular Weight |
452.916 g/mol |
SMILES |
N(C(NC(C=1C(=CC=C(C1)Cl)OC)=O)=S)C=1C=C(C2=NC3=C(C=CC=N3)O2)C=CC1C |