AC1O33XM
ethyl 2-[[2-[(2E)-2-[(4-ethoxyphenyl)methylidene]hydrazinyl]-2-oxoacetyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Also Known As: (E)-ethyl 2-(2-(2-(4-ethoxybenzylidene)hydrazinyl)-2-oxoacetamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate|2-{[1-(4-Ethoxy-phenyl)-meth-(E)-ylidene-hydrazinooxalyl]-amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylic acid ethyl ester|ethyl 2-({[(2E)-2-(4-ethoxybenzylidene)hydrazinyl](oxo)acetyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate|ethyl 2-[[2-[(2E)-2-[(4-ethoxyphenyl)methylidene]hydrazinyl]-2-oxoacetyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
| Molecular Formula | C23H27N3O5S |
|---|---|
| Molecular Weight | 457.16714 g/mol |
| LogP | 3.6812 |
| Topological Polar Surface Area | 106.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 457.16714 |
| Monoisotopic Mass | 457.16714 |
| Heavy Atoms | 32 |
| Complexity | 997.80597 |
Chemical Identifiers
| CAS Number | 847367-75-3 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)/C=N/NC(=O)C(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)OCC |
Product Overview
AC1O33XM (CAS 847367-75-3), with molecular formula C23H27N3O5S and molecular weight 457.16714 g/mol. IUPAC: ethyl 2-[[2-[(2E)-2-[(4-ethoxyphenyl)methylidene]hydrazinyl]-2-oxoacetyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate.