AC1NRB5L
6-(3,5-dimethylpiperidin-1-yl)-1,4-dimethyl-2-oxo-5-[[4-oxo-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]pyridine-3-carbonitrile
Also Known As: 6-(3,5-dimethylpiperidin-1-yl)-1,4-dimethyl-2-oxo-5-[[4-oxo-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]pyridine-3-carbonitrile|6-(3,5-Dimethylpiperidin-1-yl)-1,4-dimethyl-2-oxo-5-({4-oxo-3-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-1,2-dihydropyridine-3-carbonitrile
| Molecular Formula | C24H30N4O3S2 |
|---|---|
| Molecular Weight | 486.17593 g/mol |
| LogP | 3.4279 |
| Topological Polar Surface Area | 78.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 486.17593 |
| Monoisotopic Mass | 486.17593 |
| Heavy Atoms | 33 |
| Complexity | 1104.1768 |
Chemical Identifiers
| CAS Number | 7063-33-4 |
|---|---|
| SMILES | CC1CC(CN(C1)C2=C(C(=C(C(=O)N2C)C#N)C)C=C3C(=O)N(C(=S)S3)CC4CCCO4)C |
Product Overview
AC1NRB5L (CAS 7063-33-4), with molecular formula C24H30N4O3S2 and molecular weight 486.17593 g/mol. IUPAC: 6-(3,5-dimethylpiperidin-1-yl)-1,4-dimethyl-2-oxo-5-[[4-oxo-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]pyridine-3-carbonitrile.
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