SpectraBase Compound ID | FzcqE7La0Vu |
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InChI | InChI=1S/C25H22N2O4S/c1-4-31-25(29)18-14(2)27-24-20(19(18)15-10-12-17(30-3)13-11-15)21(26)23(32-24)22(28)16-8-6-5-7-9-16/h5-13H,4,26H2,1-3H3 |
InChIKey | XWXYSKXIXJZUJM-UHFFFAOYSA-N |
Mol Weight | 446.52 g/mol |
Molecular Formula | C25H22N2O4S |
Exact Mass | 446.130028 g/mol |
SpectraBase Spectrum ID | 6wEt4rWOPCF |
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Name | 3-amino-2-benzoyl-4-(p-methoxyphenyl)-6-methylthieno[2,3-b]pyridine-5-carboxylic acid, ethyl ester |
Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C25H22N2O4S |
InChI | InChI=1S/C25H22N2O4S/c1-4-31-25(29)18-14(2)27-24-20(19(18)15-10-12-17(30-3)13-11-15)21(26)23(32-24)22(28)16-8-6-5-7-9-16/h5-13H,4,26H2,1-3H3 |
InChIKey | XWXYSKXIXJZUJM-UHFFFAOYSA-N |
Instrument Name | Varian CFT-20 |
Sadtler NMR Number | 52457M |
Solvent | CDCl3 |