N-(2-cyanoethyl)-N-(2-fluorophenyl)-2-quinolin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-(2-fluorophenyl)-2-quinolin-2-ylsulfanyl-ethanamide Openeye Name: N-(2-cyanoethyl)-N-(2-fluorophenyl)-2-(2-quinolylsulfanyl)acetamide CAS Name: N-(2-cyanoethyl)-N-(2-fluorophenyl)-2-(2-quinolinylthio)acetamide IUPAC Name: N-(2-cyanoethyl)-N-(2-fluorophenyl)-2-quinolin-2-ylsulfanylacetamide Traditional Name: N-(2-cyanoethyl)-N-(2-fluorophenyl)-2-(2-quinolylthio)acetamide Formula: C20H16FN3OS MolecularWeight: 365.423943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)SCC(=O)N(CCC#N)C3=CC=CC=C3F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)SCC(=O)N(CCC#N)C3=CC=CC=C3F

InChI

InChI=1S/C20H16FN3OS/c21-16-7-2-4-9-18(16)24(13-5-12-22)20(25)14-26-19-11-10-15-6-1-3-8-17(15)23-19/h1-4,6-11H,5,13-14H2