SpectraBase Spectrum ID |
E5eb2WO8dnT |
Name |
methyl 4-{[(3-{[4-(methoxycarbonyl)benzyl]sulfanyl}[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)sulfanyl]methyl}benzoate |
Author |
A.V.Yarkov, IPAC, Russia |
Copyright |
Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved. |
InChI |
InChI=1S/C21H18N4O4S3/c1-28-17(26)15-7-3-13(4-8-15)11-30-19-22-23-20-25(19)24-21(32-20)31-12-14-5-9-16(10-6-14)18(27)29-2/h3-10H,11-12H2,1-2H3 |
InChIKey |
UESBEJPJLSOOHH-UHFFFAOYSA-N |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_ASIOH_7000_3662 |
Owner |
Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc. |
Sample State |
soluted |
Solvent |
DMSO-d6 |
Source File Reference |
VendorID: NMR/8241116; Labnumber: L-42.Shitov; IOH_ID: IOH-003663 |
Temperature |
303 °C |