| SpectraBase Spectrum ID |
2grjPkAhMC3 |
| Name |
(6E)-2-(2-cyclohexylethyl)-6-{[1-(4-ethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-5-imino-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/C28H33N5OS/c1-4-20-10-13-23(14-11-20)32-18(2)16-22(19(32)3)17-24-26(29)33-28(30-27(24)34)35-25(31-33)15-12-21-8-6-5-7-9-21/h10-11,13-14,16-17,21,29H,4-9,12,15H2,1-3H3/b24-17+,29-26? |
| InChIKey |
VPOGOHKHWHYMLF-IZHZPMQVSA-N |
| NMR Offset |
15.328 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_SBI_36227_28199 |
| Owner |
Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc. |
| Sample State |
soluted |
| Solvent |
ACETONE-d6 |
| Source File Reference |
VendorID: D80992; Labnumber: CEP4-5045; SBI_ID: SBI-028203 |
| Synonyms |
2-(2-cyclohexylethyl)-6-{[1-(4-ethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one |
| Temperature |
318 °C |
![(6E)-2-(2-cyclohexylethyl)-6-{[1-(4-ethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one](/api/spectrum/2grjPkAhMC3/structure.png?h=300&w=458 "(6E)-2-(2-cyclohexylethyl)-6-{[1-(4-ethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one")
