S-Ethyl 2-cyano-6-methoxy-1(2H)-quinolinecarbothioate
S-ethyl 2-cyano-6-methoxy-2H-quinoline-1-carbothioate
Also Known As: NCIMech_000243|S-Ethyl 2-cyano-6-methoxy-1(2H)-quinolinecarbothioate|NCI60_001281|S-ethyl 2-cyano-6-methoxy-2H-quinoline-1-carbothioate|1(2H)Quinolinecarbothioic acid, S-ethyl ester|1(2H)-Quinolinecarbothioic acid, S-ethyl ester|2-CYANO-6-METHOXY-1(2H)-QUINOLINECARBOTHIOIC ACID, S-ETHYL ESTER|1(2H)-Quinolinecarbothioic acid, 2-cyano-6-methoxy-, S-ethyl ester|1(2H)Quinolinecarbothioic acid, 2-cyano-6-methoxy-, S-ethyl ester|2-cyano-6-methoxy-2H-quinoline-1-carbothioic acid S-ethyl ester
| Molecular Formula | C14H14N2O2S |
|---|---|
| Molecular Weight | 274.0776 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 78.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.0776 |
| Monoisotopic Mass | 274.0776 |
| Heavy Atoms | 19 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 40448-85-9 |
|---|---|
| SMILES | CCSC(=O)N1C(C=CC2=C1C=CC(=C2)OC)C#N |
| InChIKey | RRBZCSKOQKCQJF-UHFFFAOYSA-N |
Product Overview
S-Ethyl 2-cyano-6-methoxy-1(2H)-quinolinecarbothioate (CAS 40448-85-9), with molecular formula C14H14N2O2S and molecular weight 274.0776 g/mol. IUPAC: S-ethyl 2-cyano-6-methoxy-2H-quinoline-1-carbothioate.