![Benzoic acid, 2-[[[[[4-chloro-6-[3-(trifluoromethyl)phenoxy]-2-pyrimidinyl]amino]carbonyl]amino]sulfonyl]-, methyl ester](/api/spectrum/BCX14rh2EOk/structure.png?h=300&w=458 "Benzoic acid, 2-[[[[[4-chloro-6-[3-(trifluoromethyl)phenoxy]-2-pyrimidinyl]amino]carbonyl]amino]sulfonyl]-, methyl ester")
| SpectraBase Compound ID | DekPVaRfq7U |
|---|---|
| InChI | InChI=1S/C20H14ClF3N4O6S/c1-33-17(29)13-7-2-3-8-14(13)35(31,32)28-19(30)27-18-25-15(21)10-16(26-18)34-12-6-4-5-11(9-12)20(22,23)24/h2-10H,1H3,(H2,25,26,27,28,30) |
| InChIKey | RNJZLCAHHPGZGF-UHFFFAOYSA-N |
| Mol Weight | 530.86 g/mol |
| Molecular Formula | C20H14ClF3N4O6S |
| Exact Mass | 530.027468 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | BCX14rh2EOk |
|---|---|
| Name | Benzoic acid, 2-[[[[[4-chloro-6-[3-(trifluoromethyl)phenoxy]-2-pyrimidinyl]amino]carbonyl]amino]sulfonyl]-, methyl ester |
| CAS Registry Number | 130019-74-8 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C20H14ClF3N4O6S |
| InChI | InChI=1S/C20H14ClF3N4O6S/c1-33-17(29)13-7-2-3-8-14(13)35(31,32)28-19(30)27-18-25-15(21)10-16(26-18)34-12-6-4-5-11(9-12)20(22,23)24/h2-10H,1H3,(H2,25,26,27,28,30) |
| InChIKey | RNJZLCAHHPGZGF-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |