SpectraBase Spectrum ID |
9IsKJu8anRK |
Name |
1,4-Bis{4-(benzo[b]furan-3-yl)amino-5-benzyl-1,2,4-triazol-3-ylsulfanyl}butane |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C38H34N8O2S2 |
InChI |
InChI=1S/C38H34N8O2S2/c1-3-13-27(14-4-1)23-35-39-41-37(45(35)43-31-25-47-33-19-9-7-17-29(31)33)49-21-11-12-22-50-38-42-40-36(24-28-15-5-2-6-16-28)46(38)44-32-26-48-34-20-10-8-18-30(32)34/h1-10,13-20,25-26,43-44H,11-12,21-24H2 |
InChIKey |
FFHKQGMUZXJYCN-UHFFFAOYSA-N |
Literature Reference DOI |
10.1002/hc.10191 |
Molecular Weight |
698.864 g/mol |
SMILES |
N(c1coc2ccccc12)[n]1c(SCCCCSc2[n](Nc3coc4ccccc34)c(nn2)Cc2ccccc2)nnc1Cc1ccccc1 |
SPLASH |
splash10-03y0-9635022000-1481dde191c69bb94f8d |
Source of Spectrum |
HAC-14-556-10b |
Synonyms |
5,5'-(butane-1,4-diylbis(sulfanediyl))bis(N-(benzofuran-3-yl)-3-benzyl-4H-1,2,4-triazol-4-amine) |
Wiley ID |
1775963 |