AC1NXOE3
(2Z)-2-[5-[(2-chlorophenyl)methyl]-3-(3-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-ylidene]-2-cyanoacetamide
Also Known As: (2Z)-2-[5-(2-chlorobenzyl)-3-(3-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-ylidene]-2-cyanoethanamide|(2Z)-2-[5-[(2-chlorophenyl)methyl]-3-(3-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-ylidene]-2-cyanoacetamide|(Z)-2-(5-(2-chlorobenzyl)-3-(3-methoxyphenyl)-4-oxothiazolidin-2-ylidene)-2-cyanoacetamide|2-{5-[(2-chlorophenyl)methyl]-3-(3-methoxyphenyl)-4-oxo(1,3-thiazolidin-2-ylid ene)}-2-cyanoacetamide
| Molecular Formula | C20H16ClN3O3S |
|---|---|
| Molecular Weight | 413.0601 g/mol |
| LogP | 3.26018 |
| Topological Polar Surface Area | 96.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 413.0601 |
| Monoisotopic Mass | 413.0601 |
| Heavy Atoms | 28 |
| Complexity | 1015.7507 |
Chemical Identifiers
| CAS Number | 577998-25-5 |
|---|---|
| SMILES | COC1=CC=CC(=C1)N\2C(=O)C(S/C2=C(/C#N)\C(=O)N)CC3=CC=CC=C3Cl |
Product Overview
AC1NXOE3 (CAS 577998-25-5), with molecular formula C20H16ClN3O3S and molecular weight 413.0601 g/mol. IUPAC: (2Z)-2-[5-[(2-chlorophenyl)methyl]-3-(3-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-ylidene]-2-cyanoacetamide.
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