SpectraBase Compound ID | JcpoJN9IDxd |
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InChI | InChI=1S/C21H21Cl2N3O2S/c1-3-5-16-13-9-11-29-17(13)8-10-26(16)21(27)24-19-12(2)28-25-20(19)18-14(22)6-4-7-15(18)23/h4,6-7,9,11,16H,3,5,8,10H2,1-2H3,(H,24,27) |
InChIKey | HQKCALDTVIPEMD-UHFFFAOYSA-N |
Mol Weight | 450.38 g/mol |
Molecular Formula | C21H21Cl2N3O2S |
Exact Mass | 449.073154 g/mol |
SpectraBase Spectrum ID | 34HZEsSQN4R |
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Name | N-[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]-4-propyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-5-carboxamide |
Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C21H21Cl2N3O2S |
InChI | InChI=1S/C21H21Cl2N3O2S/c1-3-5-16-13-9-11-29-17(13)8-10-26(16)21(27)24-19-12(2)28-25-20(19)18-14(22)6-4-7-15(18)23/h4,6-7,9,11,16H,3,5,8,10H2,1-2H3,(H,24,27) |
InChIKey | HQKCALDTVIPEMD-UHFFFAOYSA-N |
Instrument Name | Varian CFT-20 |
Sadtler NMR Number | 57129M |
Solvent | CDCl3 |