SpectraBase Compound ID | J1RlZ3l9uVH |
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InChI | InChI=1S/C23H25N5O2S/c1-15-11-13-17(14-12-15)31(29,30)23-22-25-21(24-19-9-5-3-7-16(19)2)18-8-4-6-10-20(18)28(22)27-26-23/h4,6,8,10-14,16,19H,3,5,7,9H2,1-2H3,(H,24,25) |
InChIKey | UTNSJVOJPANANC-UHFFFAOYSA-N |
Mol Weight | 435.55 g/mol |
Molecular Formula | C23H25N5O2S |
Exact Mass | 435.172896 g/mol |
SpectraBase Spectrum ID | 3GvimeI7Gz0 |
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Name | [1,2,3]triazolo[1,5-a]quinazolin-5-amine, N-(2-methylcyclohexyl)-3-[(4-methylphenyl)sulfonyl]- |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 435.172896237 u |
Formula | C23H25N5O2S |
InChI | InChI=1S/C23H25N5O2S/c1-15-11-13-17(14-12-15)31(29,30)23-22-25-21(24-19-9-5-3-7-16(19)2)18-8-4-6-10-20(18)28(22)27-26-23/h4,6,8,10-14,16,19H,3,5,7,9H2,1-2H3,(H,24,25) |
InChIKey | UTNSJVOJPANANC-UHFFFAOYSA-N |
Molecular Weight | 435.546 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2021_6502 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/13289742 |