SpectraBase Spectrum ID |
Ll7ZltctGV1 |
Name |
Methyl 2-({2-[(4,5-dibenzyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzenecarboxylate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C26H24N4O3S |
InChI |
InChI=1S/C26H24N4O3S/c1-33-25(32)21-14-8-9-15-22(21)27-24(31)18-34-26-29-28-23(16-19-10-4-2-5-11-19)30(26)17-20-12-6-3-7-13-20/h2-15H,16-18H2,1H3,(H,27,31) |
InChIKey |
MJNZDUOWMCLCPD-UHFFFAOYSA-N |
Molecular Weight |
472.563 g/mol |
SMILES |
N(c1c(C(=O)OC)cccc1)C(CSc1[n](c(nn1)Cc1ccccc1)Cc1ccccc1)=O |
SPLASH |
splash10-0006-9410000000-e76411ea01736daa329d |
Source of Spectrum |
IY-1-4480-8 |
Synonyms |
2-[[2-[[4,5-bis(phenylmethyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]benzoic acid methyl ester
Methyl 2-[[2-[(4,5-dibenzyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoate
Methyl 2-[2-[[4,5-bis(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzoate |
Wiley ID |
1652791 |