| SpectraBase Spectrum ID |
5PYYQpezzJu |
| Name |
(6E)-2-(2-cyclohexylethyl)-6-{[2,5-dimethyl-1-(4-methylphenyl)-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/C27H31N5OS/c1-17-9-12-22(13-10-17)31-18(2)15-21(19(31)3)16-23-25(28)32-27(29-26(23)33)34-24(30-32)14-11-20-7-5-4-6-8-20/h9-10,12-13,15-16,20,28H,4-8,11,14H2,1-3H3/b23-16+,28-25? |
| InChIKey |
OQEXKWZGMYGICR-ITCQOWKOSA-N |
| NMR Offset |
15.328 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_SBI_36227_28205 |
| 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: D80998; Labnumber: CEP4-5087; SBI_ID: SBI-028209 |
| Synonyms |
2-(2-cyclohexylethyl)-6-{[2,5-dimethyl-1-(4-methylphenyl)-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-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one](/api/spectrum/5PYYQpezzJu/structure.png?h=300&w=458 "(6E)-2-(2-cyclohexylethyl)-6-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one")
