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| IUPAC Name: | 2-chloro-1-[[(2R)-2-methyloxiran-2-yl]methyl]-4-nitroimidazole |
| Description: | 2-Chloro-1-[[(2R)-2-methyloxiranyl]methyl]-4-nitro-1H-imidazole is an intermediate in the synthesis of Delamanid (D230660), a novel anti-tuberculosis medication that inhibits mycolic acid synthesis and shows potent in-vitro and in-vivo activity against drug-resistant strains of Mycobacterium tuberculosis. |
| Molecular Weight: | 217.61 |
| Molecular Formula: | C7H8ClN3O3 |
| Canonical SMILES: | CC1(CO1)CN2C=C(N=C2Cl)[N+](=O)[O-] |
| InChI: | InChI=1S/C7H8ClN3O3/c1-7(4-14-7)3-10-2-5(11(12)13)9-6(10)8/h2H,3-4H2,1H3/t7-/m1/s1 |
| InChI Key: | SZMDGYNOADBVSR-SSDOTTSWSA-N |
| Solubility: | Chloroform, DCM |
| Appearance: | Off-White Solid |
| References: | Sasaki, H., et al. J. Med. Chem., 49, 7854 (2006). |
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