![N'-tert-butyl-N-[2-(5-chloro-2-methyl-1H-indol-3-yl)ethyl]-N-(2-thienylmethyl)thiourea](/api/spectrum/7BXL81VUvvC/structure.png?h=300&w=458 "N'-tert-butyl-N-[2-(5-chloro-2-methyl-1H-indol-3-yl)ethyl]-N-(2-thienylmethyl)thiourea")
| SpectraBase Compound ID | LqfY3j97zRs |
|---|---|
| InChI | InChI=1S/C21H26ClN3S2/c1-14-17(18-12-15(22)7-8-19(18)23-14)9-10-25(13-16-6-5-11-27-16)20(26)24-21(2,3)4/h5-8,11-12,23H,9-10,13H2,1-4H3,(H,24,26) |
| InChIKey | VAJYCFFLLYOFLH-UHFFFAOYSA-N |
| Mol Weight | 420.03 g/mol |
| Molecular Formula | C21H26ClN3S2 |
| Exact Mass | 419.125668 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 7BXL81VUvvC |
|---|---|
| Name | N'-tert-butyl-N-[2-(5-chloro-2-methyl-1H-indol-3-yl)ethyl]-N-(2-thienylmethyl)thiourea |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 419.125667897 u |
| Formula | C21H26ClN3S2 |
| InChI | InChI=1S/C21H26ClN3S2/c1-14-17(18-12-15(22)7-8-19(18)23-14)9-10-25(13-16-6-5-11-27-16)20(26)24-21(2,3)4/h5-8,11-12,23H,9-10,13H2,1-4H3,(H,24,26) |
| InChIKey | VAJYCFFLLYOFLH-UHFFFAOYSA-N |
| Molecular Weight | 420.033 g/mol |
| NMR Offset | 17.9885 |
| NMR Spectrometer Frequency | 500.132 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_8648 |
| Solvent | CDCl3 |
| Source | Vendor ID: NMR/13219939 |