ChemDiv1_028821
ethyl 6-[2-(4-chloroanilino)-2-oxoethyl]sulfanyl-4-(2-chlorophenyl)-5-cyano-2-oxo-3,4-dihydro-1H-pyridine-3-carboxylate
Also Known As: ChemDiv1_028821|Oprea1_259201|HMS668O01|SR-01000484558-1|ethyl 4-(2-chlorophenyl)-6-({2-[(4-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate|ethyl 4-(2-chlorophenyl)-6-((2-((4-chlorophenyl)amino)-2-oxoethyl)thio)-5-cyano-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate|ETHYL 4-(2-CHLOROPHENYL)-6-({[(4-CHLOROPHENYL)CARBAMOYL]METHYL}SULFANYL)-5-CYANO-2-OXO-1,2,3,4-TETRAHYDROPYRIDINE-3-CARBOXYLATE|ethyl 4-(2-chlorophenyl)-6-({2-[(4-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-hydroxy-3,4-dihydropyridine-3-carboxylate|ethyl 6-[2-(4-chloroanilino)-2-oxoethyl]sulfanyl-4-(2-chlorophenyl)-5-cyano-2-oxo-3,4-dihydro-1H-pyridine-3-carboxylate
| Molecular Formula | C23H19Cl2N3O4S |
|---|---|
| Molecular Weight | 503.04733 g/mol |
| LogP | 4.49318 |
| Topological Polar Surface Area | 108.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 503.04733 |
| Monoisotopic Mass | 503.04733 |
| Heavy Atoms | 33 |
| Complexity | 1145.1406 |
Chemical Identifiers
| CAS Number | 369393-78-2 |
|---|---|
| SMILES | CCOC(=O)C1C(C(=C(NC1=O)SCC(=O)NC2=CC=C(C=C2)Cl)C#N)C3=CC=CC=C3Cl |
Product Overview
ChemDiv1_028821 (CAS 369393-78-2), with molecular formula C23H19Cl2N3O4S and molecular weight 503.04733 g/mol. IUPAC: ethyl 6-[2-(4-chloroanilino)-2-oxoethyl]sulfanyl-4-(2-chlorophenyl)-5-cyano-2-oxo-3,4-dihydro-1H-pyridine-3-carboxylate.
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