AC1LYXD0
ethyl 4-[(7Z)-7-(5-chloro-2-oxo-1H-indol-3-ylidene)-6-oxo-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-3-yl]benzoate
Also Known As: (Z)-ethyl 4-(7-(5-chloro-2-oxoindolin-3-ylidene)-6-oxo-6,7-dihydro-2H-thiazolo[3,2-a][1,3,5]triazin-3(4H)-yl)benzoate|ethyl 4-[(7Z)-7-(5-chloro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-6-oxo-6,7-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-3(4H)-yl]benzoate|ethyl 4-[(7Z)-7-(5-chloro-2-oxo-1H-indol-3-ylidene)-6-oxo-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-3-yl]benzoate
| Molecular Formula | C22H17ClN4O4S |
|---|---|
| Molecular Weight | 468.06592 g/mol |
| LogP | 1.9458 |
| Topological Polar Surface Area | 93.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 468.06592 |
| Monoisotopic Mass | 468.06592 |
| Heavy Atoms | 32 |
| Complexity | 1442.0394 |
Chemical Identifiers
| CAS Number | 840468-96-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N2CN=C3N(C2)C(=O)/C(=C/4\C5=C(C=CC(=C5)Cl)NC4=O)/S3 |
Product Overview
AC1LYXD0 (CAS 840468-96-4), with molecular formula C22H17ClN4O4S and molecular weight 468.06592 g/mol. IUPAC: ethyl 4-[(7Z)-7-(5-chloro-2-oxo-1H-indol-3-ylidene)-6-oxo-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-3-yl]benzoate.
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