![N-{(E)-(4-benzyl-1-piperidinyl)[(4,6-dimethyl-2-pyrimidinyl)amino]methylidene}-N'-(3,4-dichlorophenyl)urea](/api/spectrum/EHaHlo8dfJm/structure.png?h=300&w=458 "N-{(E)-(4-benzyl-1-piperidinyl)[(4,6-dimethyl-2-pyrimidinyl)amino]methylidene}-N'-(3,4-dichlorophenyl)urea")
| SpectraBase Compound ID | IxsFAJ5yCKS |
|---|---|
| InChI | InChI=1S/C26H28Cl2N6O/c1-17-14-18(2)30-24(29-17)32-25(33-26(35)31-21-8-9-22(27)23(28)16-21)34-12-10-20(11-13-34)15-19-6-4-3-5-7-19/h3-9,14,16,20H,10-13,15H2,1-2H3,(H2,29,30,31,32,33,35) |
| InChIKey | BMABQSKEYAHAAC-UHFFFAOYSA-N |
| Mol Weight | 511.46 g/mol |
| Molecular Formula | C26H28Cl2N6O |
| Exact Mass | 510.170165 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | EHaHlo8dfJm |
|---|---|
| Name | N-{(E)-(4-benzyl-1-piperidinyl)[(4,6-dimethyl-2-pyrimidinyl)amino]methylidene}-N'-(3,4-dichlorophenyl)urea |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 510.170164945 u |
| Formula | C26H28Cl2N6O |
| InChI | InChI=1S/C26H28Cl2N6O/c1-17-14-18(2)30-24(29-17)32-25(33-26(35)31-21-8-9-22(27)23(28)16-21)34-12-10-20(11-13-34)15-19-6-4-3-5-7-19/h3-9,14,16,20H,10-13,15H2,1-2H3,(H2,29,30,31,32,33,35) |
| InChIKey | BMABQSKEYAHAAC-UHFFFAOYSA-N |
| Molecular Weight | 511.457 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_303 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12268006 |