![Benzoic acid, 2-[[[[[4-chloro-6-(3-methoxyphenoxy)-2-pyrimidinyl]amino]carbonyl]amino]sulfonyl]-, 2-chloroethyl ester](/api/spectrum/HzkWhOWBziv/structure.png?h=300&w=458 "Benzoic acid, 2-[[[[[4-chloro-6-(3-methoxyphenoxy)-2-pyrimidinyl]amino]carbonyl]amino]sulfonyl]-, 2-chloroethyl ester")
| SpectraBase Compound ID | 3XPHYKfj3lK |
|---|---|
| InChI | InChI=1S/C21H18Cl2N4O7S/c1-32-13-5-4-6-14(11-13)34-18-12-17(23)24-20(25-18)26-21(29)27-35(30,31)16-8-3-2-7-15(16)19(28)33-10-9-22/h2-8,11-12H,9-10H2,1H3,(H2,24,25,26,27,29) |
| InChIKey | SNOFLERWQBIOTE-UHFFFAOYSA-N |
| Mol Weight | 541.36 g/mol |
| Molecular Formula | C21H18Cl2N4O7S |
| Exact Mass | 540.027326 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | HzkWhOWBziv |
|---|---|
| Name | Benzoic acid, 2-[[[[[4-chloro-6-(3-methoxyphenoxy)-2-pyrimidinyl]amino]carbonyl]amino]sulfonyl]-, 2-chloroethyl ester |
| CAS Registry Number | 130035-33-5 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C21H18Cl2N4O7S |
| InChI | InChI=1S/C21H18Cl2N4O7S/c1-32-13-5-4-6-14(11-13)34-18-12-17(23)24-20(25-18)26-21(29)27-35(30,31)16-8-3-2-7-15(16)19(28)33-10-9-22/h2-8,11-12H,9-10H2,1H3,(H2,24,25,26,27,29) |
| InChIKey | SNOFLERWQBIOTE-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |