![Benzoic acid, 2-chloro-6-[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]-, ethyl ester](/api/spectrum/IrZplawqmyI/structure.png?h=300&w=458 "Benzoic acid, 2-chloro-6-[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]-, ethyl ester")
| SpectraBase Compound ID | Cdkx7czdlTc |
|---|---|
| InChI | InChI=1S/C16H17ClN4O7S/c1-4-28-14(22)13-9(17)6-5-7-10(13)29(24,25)21-16(23)20-15-18-11(26-2)8-12(19-15)27-3/h5-8H,4H2,1-3H3,(H2,18,19,20,21,23) |
| InChIKey | ICRVHWXXBWYTHX-UHFFFAOYSA-N |
| Mol Weight | 444.85 g/mol |
| Molecular Formula | C16H17ClN4O7S |
| Exact Mass | 444.050648 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | IrZplawqmyI |
|---|---|
| Name | Benzoic acid, 2-chloro-6-[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]-, ethyl ester |
| CAS Registry Number | 120257-23-0 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C16H17ClN4O7S |
| InChI | InChI=1S/C16H17ClN4O7S/c1-4-28-14(22)13-9(17)6-5-7-10(13)29(24,25)21-16(23)20-15-18-11(26-2)8-12(19-15)27-3/h5-8H,4H2,1-3H3,(H2,18,19,20,21,23) |
| InChIKey | ICRVHWXXBWYTHX-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 85 |
| Purity | slightly contaminated |
| Technique | KBr-Pellet |