SpectraBase Spectrum ID |
2rhCR6XO1an |
Name |
Ethyl 4-(5-{(E)-[({5-[(2-methylbenzoyl)amino]-1,3,4-thiadiazol-2-yl}acetyl)hydrazono]methyl}-2-furyl)benzoate |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
517.141990030 u |
Formula |
C26H23N5O5S |
InChI |
InChI=1S/C26H23N5O5S/c1-3-35-25(34)18-10-8-17(9-11-18)21-13-12-19(36-21)15-27-29-22(32)14-23-30-31-26(37-23)28-24(33)20-7-5-4-6-16(20)2/h4-13,15H,3,14H2,1-2H3,(H,29,32)(H,28,31,33)/b27-15+ |
InChIKey |
LPJLDFOXTLZSBA-JFLMPSFJSA-N |
Molecular Weight |
517.560 g/mol |
SMILES |
N(\N=C\C=1OC(C2=CC=C(C(=O)OCC)C=C2)=CC1)C(CC=1SC(=NN1)NC(C1=C(C)C=CC=C1)=O)=O |