ChemDiv1_028529
N-(3-chloro-2-methylphenyl)-2-[[3-cyano-4-(furan-2-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]acetamide
Also Known As: ChemDiv1_028529|Oprea1_513753|Oprea1_725640|HMS668A17|AB00685687-01|AE-848/40937579|N-(3-chloro-2-methylphenyl)-2-{[3-cyano-4-(furan-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}acetamide|SR-01000484688-1|F1155-0290|N-(3-chloro-2-methylphenyl)-2-((3-cyano-4-(furan-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl)thio)acetamide|N-(3-chloro-2-methylphenyl)-2-{[3-cyano-4-(furan-2-yl)-5-hydroxy-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide|N-(3-chloro-2-methylphenyl)-2-[[3-cyano-4-(furan-2-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]acetamide|N-(3-chloro-2-methylphenyl)-2-{[3-cyano-4-(2-furyl)-5-oxo-1,4,5,6,7,8-hexahydro-2-quinolinyl]sulfanyl}acetamide
| Molecular Formula | C23H20ClN3O3S |
|---|---|
| Molecular Weight | 453.0914 g/mol |
| LogP | 5.0424 |
| Topological Polar Surface Area | 95.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 453.0914 |
| Monoisotopic Mass | 453.0914 |
| Heavy Atoms | 31 |
| Complexity | 1145.3116 |
Chemical Identifiers
| CAS Number | 369394-47-8 |
|---|---|
| SMILES | CC1=C(C=CC=C1Cl)NC(=O)CSC2=C(C(C3=C(N2)CCCC3=O)C4=CC=CO4)C#N |
Product Overview
ChemDiv1_028529 (CAS 369394-47-8), with molecular formula C23H20ClN3O3S and molecular weight 453.0914 g/mol. IUPAC: N-(3-chloro-2-methylphenyl)-2-[[3-cyano-4-(furan-2-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]acetamide.