![Benzoic acid, 2-[[[[[4-(1H-imidazol-1-yl)-6-methyl-2-pyrimidinyl]amino]carbonyl]amino]sulfonyl]-, methyl ester](/api/spectrum/1UpBe2AxqXr/structure.png?h=300&w=458 "Benzoic acid, 2-[[[[[4-(1H-imidazol-1-yl)-6-methyl-2-pyrimidinyl]amino]carbonyl]amino]sulfonyl]-, methyl ester")
| SpectraBase Compound ID | LJWmDDKtE6p |
|---|---|
| InChI | InChI=1S/C17H16N6O5S/c1-11-9-14(23-8-7-18-10-23)20-16(19-11)21-17(25)22-29(26,27)13-6-4-3-5-12(13)15(24)28-2/h3-10H,1-2H3,(H2,19,20,21,22,25) |
| InChIKey | GJKNOTFIDVRUIT-UHFFFAOYSA-N |
| Mol Weight | 416.41 g/mol |
| Molecular Formula | C17H16N6O5S |
| Exact Mass | 416.090289 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 1UpBe2AxqXr |
|---|---|
| Name | Benzoic acid, 2-[[[[[4-(1H-imidazol-1-yl)-6-methyl-2-pyrimidinyl]amino]carbonyl]amino]sulfonyl]-, methyl ester |
| CAS Registry Number | 115930-82-0 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C17H16N6O5S |
| InChI | InChI=1S/C17H16N6O5S/c1-11-9-14(23-8-7-18-10-23)20-16(19-11)21-17(25)22-29(26,27)13-6-4-3-5-12(13)15(24)28-2/h3-10H,1-2H3,(H2,19,20,21,22,25) |
| InChIKey | GJKNOTFIDVRUIT-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |