AC1LUTE1
ethyl 2-[[(Z)-2-cyano-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]ethenyl]amino]-4,5-dimethylthiophene-3-carboxylate
Also Known As: F3220-0098|(Z)-ethyl 2-((2-cyano-2-(4-(4-nitrophenyl)thiazol-2-yl)vinyl)amino)-4,5-dimethylthiophene-3-carboxylate|ethyl 2-{[(1Z)-2-cyano-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]eth-1-en-1-yl]amino}-4,5-dimethylthiophene-3-carboxylate|ethyl 2-[[(Z)-2-cyano-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]ethenyl]amino]-4,5-dimethylthiophene-3-carboxylate|ethyl 2-({(Z)-2-cyano-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]ethenyl}amino)-4,5-dimethylthiophene-3-carboxylate
| Molecular Formula | C21H18N4O4S2 |
|---|---|
| Molecular Weight | 454.07693 g/mol |
| LogP | 5.54992 |
| Topological Polar Surface Area | 118.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 454.07693 |
| Monoisotopic Mass | 454.07693 |
| Heavy Atoms | 31 |
| Complexity | 1203.188 |
Chemical Identifiers
| CAS Number | 577982-52-6 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C)N/C=C(/C#N)\C2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
AC1LUTE1 (CAS 577982-52-6), with molecular formula C21H18N4O4S2 and molecular weight 454.07693 g/mol. IUPAC: ethyl 2-[[(Z)-2-cyano-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]ethenyl]amino]-4,5-dimethylthiophene-3-carboxylate.