6-(azepan-1-yl)-1-ethyl-5-[[3-[(4-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-4-methyl-2-oxopyridine-3-carbonitrile structure
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Common Name | 6-(azepan-1-yl)-1-ethyl-5-[[3-[(4-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-4-methyl-2-oxopyridine-3-carbonitrile | ||
|---|---|---|---|---|
| CAS Number | 7063-96-9 | Molecular Weight | 522.68200 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C27H30N4O3S2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | 6-(azepan-1-yl)-1-ethyl-5-[[3-[(4-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-4-methyl-2-oxopyridine-3-carbonitrile |
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| Molecular Formula | C27H30N4O3S2 |
|---|---|
| Molecular Weight | 522.68200 |
| Exact Mass | 522.17600 |
| PSA | 135.96000 |
| LogP | 4.84158 |
| InChIKey | IBBLHVKGPGIPIW-UHFFFAOYSA-N |
| SMILES | CCn1c(N2CCCCCC2)c(C=C2SC(=S)N(Cc3ccc(OC)cc3)C2=O)c(C)c(C#N)c1=O |