AC1NRGQ1
1-butyl-6-(3,5-dimethylpiperidin-1-yl)-5-[[3-(furan-2-ylmethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-4-methyl-2-oxopyridine-3-carbonitrile
Also Known As: 1-Butyl-6-(3,5-dimethylpiperidin-1-yl)-5-({3-[(furan-2-yl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-4-methyl-2-oxo-1,2-dihydropyridine-3-carbonitrile|1-butyl-6-(3,5-dimethylpiperidin-1-yl)-5-[[3-(furan-2-ylmethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-4-methyl-2-oxopyridine-3-carbonitrile
| Molecular Formula | C27H32N4O3S2 |
|---|---|
| Molecular Weight | 524.1916 g/mol |
| LogP | 5.3052 |
| Topological Polar Surface Area | 82.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 524.1916 |
| Monoisotopic Mass | 524.1916 |
| Heavy Atoms | 36 |
| Complexity | 1279.5627 |
Chemical Identifiers
| CAS Number | 7064-98-4 |
|---|---|
| SMILES | CCCCN1C(=C(C(=C(C1=O)C#N)C)C=C2C(=O)N(C(=S)S2)CC3=CC=CO3)N4CC(CC(C4)C)C |
Product Overview
AC1NRGQ1 (CAS 7064-98-4), with molecular formula C27H32N4O3S2 and molecular weight 524.1916 g/mol. IUPAC: 1-butyl-6-(3,5-dimethylpiperidin-1-yl)-5-[[3-(furan-2-ylmethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-4-methyl-2-oxopyridine-3-carbonitrile.
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