AC1M22XU
(E)-2-(benzenesulfonyl)-3-(2,5-dimethylanilino)-3-[(2-fluorophenyl)methylsulfanyl]prop-2-enenitrile
Also Known As: (2E)-2-(BENZENESULFONYL)-3-[(2,5-DIMETHYLPHENYL)AMINO]-3-{[(2-FLUOROPHENYL)METHYL]SULFANYL}PROP-2-ENENITRILE|F1602-0811|(E)-3-((2,5-dimethylphenyl)amino)-3-((2-fluorobenzyl)thio)-2-(phenylsulfonyl)acrylonitrile|(E)-2-(benzenesulfonyl)-3-(2,5-dimethylanilino)-3-[(2-fluorophenyl)methylsulfanyl]prop-2-enenitrile
| Molecular Formula | C24H21FN2O2S2 |
|---|---|
| Molecular Weight | 452.10284 g/mol |
| LogP | 5.95442 |
| Topological Polar Surface Area | 69.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 452.10284 |
| Monoisotopic Mass | 452.10284 |
| Heavy Atoms | 31 |
| Complexity | 1264.2368 |
Chemical Identifiers
| CAS Number | 866348-31-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)N/C(=C(/C#N)\S(=O)(=O)C2=CC=CC=C2)/SCC3=CC=CC=C3F |
Product Overview
AC1M22XU (CAS 866348-31-4), with molecular formula C24H21FN2O2S2 and molecular weight 452.10284 g/mol. IUPAC: (E)-2-(benzenesulfonyl)-3-(2,5-dimethylanilino)-3-[(2-fluorophenyl)methylsulfanyl]prop-2-enenitrile.
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