SpectraBase Spectrum ID |
DjyUDYHV0bP |
Name |
4-[(E)-(5-imino-7-oxo-2-(3-pyridinyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]phenyl methanesulfonate |
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/C18H13N5O4S2/c1-29(25,26)27-13-6-4-11(5-7-13)9-14-15(19)23-18(21-16(14)24)28-17(22-23)12-3-2-8-20-10-12/h2-10,19H,1H3/b14-9+,19-15? |
InChIKey |
SEKHTFNFTZJYEN-DIQJHTJGSA-N |
NMR Offset |
15.5012 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_36227_21579 |
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: D55095; Labnumber: CEP5-0127; SBI_ID: SBI-021583 |
Synonyms |
4-[(5-imino-7-oxo-2-(3-pyridinyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]phenyl methanesulfonate |
Temperature |
315 °C |