SpectraBase Compound ID | 5Y42fBogYOI |
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InChI | InChI=1S/C26H25N5OS/c1-30(17-18-8-3-2-4-9-18)15-7-14-27-25(32)19-12-13-20-22(16-19)29-26(33)31-23-11-6-5-10-21(23)28-24(20)31/h2-6,8-13,16H,7,14-15,17H2,1H3,(H,27,32)(H,29,33) |
InChIKey | CCDZHUOUJBLQOG-UHFFFAOYSA-N |
Mol Weight | 455.58 g/mol |
Molecular Formula | C26H25N5OS |
Exact Mass | 455.177982 g/mol |
SpectraBase Spectrum ID | 7juYRcMEaUw |
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Name | N-{3-[benzyl(methyl)amino]propyl}-6-thioxo-5,6-dihydrobenzimidazo[1,2-c]quinazoline-3-carboxamide |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 455.177981618 u |
Formula | C26H25N5OS |
InChI | InChI=1S/C26H25N5OS/c1-30(17-18-8-3-2-4-9-18)15-7-14-27-25(32)19-12-13-20-22(16-19)29-26(33)31-23-11-6-5-10-21(23)28-24(20)31/h2-6,8-13,16H,7,14-15,17H2,1H3,(H,27,32)(H,29,33) |
InChIKey | CCDZHUOUJBLQOG-UHFFFAOYSA-N |
Molecular Weight | 455.580 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_3166 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/12288529 |