ARONIS018246
ethyl 2-[(E)-(2-chloro-5-nitrophenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: AG-205/33656020|A1806/0076306|ethyl 2-({2-chloro-5-nitrobenzylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|ethyl 2-[(2-chloro-5-nitrobenzylidene)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|ethyl 2-[(E)-(2-chloro-5-nitrophenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|ETHYL 2-[(E)-[(2-CHLORO-5-NITROPHENYL)METHYLIDENE]AMINO]-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE|ethyl 2-{[(E)-(2-chloro-5-nitrophenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C18H17ClN2O4S |
|---|---|
| Molecular Weight | 392.05975 g/mol |
| LogP | 5.1158 |
| Topological Polar Surface Area | 81.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 392.05975 |
| Monoisotopic Mass | 392.05975 |
| Heavy Atoms | 26 |
| Complexity | 891.5565 |
Chemical Identifiers
| CAS Number | 304666-44-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)/N=C/C3=C(C=CC(=C3)[N+](=O)[O-])Cl |
Product Overview
ARONIS018246 (CAS 304666-44-2), with molecular formula C18H17ClN2O4S and molecular weight 392.05975 g/mol. IUPAC: ethyl 2-[(E)-(2-chloro-5-nitrophenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.