![N-[2-(5-chloro-2-methyl-1H-indol-3-yl)ethyl]-N'-(2,5-dimethylphenyl)-N-(2-pyridinylmethyl)thiourea](/api/spectrum/IvYLGnMAqR0/structure.png?h=300&w=458 "N-[2-(5-chloro-2-methyl-1H-indol-3-yl)ethyl]-N'-(2,5-dimethylphenyl)-N-(2-pyridinylmethyl)thiourea")
| SpectraBase Compound ID | IUQJKAQ2GLX |
|---|---|
| InChI | InChI=1S/C26H27ClN4S/c1-17-7-8-18(2)25(14-17)30-26(32)31(16-21-6-4-5-12-28-21)13-11-22-19(3)29-24-10-9-20(27)15-23(22)24/h4-10,12,14-15,29H,11,13,16H2,1-3H3,(H,30,32) |
| InChIKey | YGULPTWNAATNMV-UHFFFAOYSA-N |
| Mol Weight | 463.04 g/mol |
| Molecular Formula | C26H27ClN4S |
| Exact Mass | 462.164496 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | IvYLGnMAqR0 |
|---|---|
| Name | N-[2-(5-chloro-2-methyl-1H-indol-3-yl)ethyl]-N'-(2,5-dimethylphenyl)-N-(2-pyridinylmethyl)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 | 462.164495759 u |
| Formula | C26H27ClN4S |
| InChI | InChI=1S/C26H27ClN4S/c1-17-7-8-18(2)25(14-17)30-26(32)31(16-21-6-4-5-12-28-21)13-11-22-19(3)29-24-10-9-20(27)15-23(22)24/h4-10,12,14-15,29H,11,13,16H2,1-3H3,(H,30,32) |
| InChIKey | YGULPTWNAATNMV-UHFFFAOYSA-N |
| Molecular Weight | 463.043 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_8683 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/13219987 |