2-[3-[(4-methoxy-3-nitrophenyl)methyl]-2-methyl-5-nitroimidazol-4-yl]sulfanylacetonitrile structure
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Common Name | 2-[3-[(4-methoxy-3-nitrophenyl)methyl]-2-methyl-5-nitroimidazol-4-yl]sulfanylacetonitrile | ||
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| CAS Number | 77952-82-0 | Molecular Weight | 363.34900 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C14H13N5O5S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | 2-[3-[(4-methoxy-3-nitrophenyl)methyl]-2-methyl-5-nitroimidazol-4-yl]sulfanylacetonitrile |
|---|
| Molecular Formula | C14H13N5O5S |
|---|---|
| Molecular Weight | 363.34900 |
| Exact Mass | 363.06400 |
| PSA | 167.78000 |
| LogP | 3.72688 |
| InChIKey | JYXLTNKUKFFNMH-UHFFFAOYSA-N |
| SMILES | COc1ccc(Cn2c(C)nc([N+](=O)[O-])c2SCC#N)cc1[N+](=O)[O-] |