| SpectraBase Spectrum ID |
7hLaX7tcnGe |
| Name |
(6E)-2-(1,3-benzodioxol-5-yl)-5-imino-6-{4-[(2-methylbenzyl)oxy]benzylidene}-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one |
| 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/C27H20N4O4S/c1-16-4-2-3-5-19(16)14-33-20-9-6-17(7-10-20)12-21-24(28)31-27(29-25(21)32)36-26(30-31)18-8-11-22-23(13-18)35-15-34-22/h2-13,28H,14-15H2,1H3/b21-12+,28-24? |
| InChIKey |
PPYCVDHSPJTYMR-YOXBEJIOSA-N |
| NMR Offset |
15.328 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_SBI_36227_25832 |
| 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: D61651; Labnumber: CEP4-3546; SBI_ID: SBI-025836 |
| Synonyms |
2-(1,3-benzodioxol-5-yl)-5-imino-6-{4-[(2-methylbenzyl)oxy]benzylidene}-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one |
| Temperature |
318 °C |
![(6E)-2-(1,3-benzodioxol-5-yl)-5-imino-6-{4-[(2-methylbenzyl)oxy]benzylidene}-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one](/api/spectrum/7hLaX7tcnGe/structure.png?h=300&w=458 "(6E)-2-(1,3-benzodioxol-5-yl)-5-imino-6-{4-[(2-methylbenzyl)oxy]benzylidene}-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one")
