![N-cyclohexyl-2-[(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]butanamide](/api/spectrum/59MKpGMDUsP/structure.png?h=300&w=458 "N-cyclohexyl-2-[(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]butanamide")
| SpectraBase Compound ID | LPWv4ljw2oD |
|---|---|
| InChI | InChI=1S/C27H31N5O3S/c1-4-23(26(33)28-18-13-9-6-10-14-18)36-27-29-20-16-22(35-3)21(34-2)15-19(20)25-30-24(31-32(25)27)17-11-7-5-8-12-17/h5,7-8,11-12,15-16,18,23H,4,6,9-10,13-14H2,1-3H3,(H,28,33) |
| InChIKey | PLPUVIZUJCTHOL-UHFFFAOYSA-N |
| Mol Weight | 505.64 g/mol |
| Molecular Formula | C27H31N5O3S |
| Exact Mass | 505.214761 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 59MKpGMDUsP |
|---|---|
| Name | N-cyclohexyl-2-[(8,9-dimethoxy-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]butanamide |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 505.214761049 u |
| Formula | C27H31N5O3S |
| InChI | InChI=1S/C27H31N5O3S/c1-4-23(26(33)28-18-13-9-6-10-14-18)36-27-29-20-16-22(35-3)21(34-2)15-19(20)25-30-24(31-32(25)27)17-11-7-5-8-12-17/h5,7-8,11-12,15-16,18,23H,4,6,9-10,13-14H2,1-3H3,(H,28,33) |
| InChIKey | PLPUVIZUJCTHOL-UHFFFAOYSA-N |
| Molecular Weight | 505.637 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_7039 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12329524 |