![Benzoic acid, 2-chloro-6-[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]-, propyl ester](/api/spectrum/66runzbN1Kr/structure.png?h=300&w=458 "Benzoic acid, 2-chloro-6-[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]-, propyl ester")
| SpectraBase Compound ID | H9mZqi4V2yI |
|---|---|
| InChI | InChI=1S/C17H19ClN4O7S/c1-4-8-29-15(23)14-10(18)6-5-7-11(14)30(25,26)22-17(24)21-16-19-12(27-2)9-13(20-16)28-3/h5-7,9H,4,8H2,1-3H3,(H2,19,20,21,22,24) |
| InChIKey | NEOBEAZWJWANHX-UHFFFAOYSA-N |
| Mol Weight | 458.87 g/mol |
| Molecular Formula | C17H19ClN4O7S |
| Exact Mass | 458.066298 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 66runzbN1Kr |
|---|---|
| Name | Benzoic acid, 2-chloro-6-[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]-, propyl ester |
| CAS Registry Number | 120257-24-1 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C17H19ClN4O7S |
| InChI | InChI=1S/C17H19ClN4O7S/c1-4-8-29-15(23)14-10(18)6-5-7-11(14)30(25,26)22-17(24)21-16-19-12(27-2)9-13(20-16)28-3/h5-7,9H,4,8H2,1-3H3,(H2,19,20,21,22,24) |
| InChIKey | NEOBEAZWJWANHX-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 85 |
| Purity | slightly contaminated |
| Technique | KBr-Pellet |