2-[ethyl(2-quinolin-2-ylsulfanylethanoyl)amino]-N-[(4-fluorophenyl)methyl]ethanamide

Systemtic Name: 2-[ethyl(2-quinolin-2-ylsulfanylethanoyl)amino]-N-[(4-fluorophenyl)methyl]ethanamide Openeye Name: 2-[ethyl-[2-(2-quinolylsulfanyl)acetyl]amino]-N-[(4-fluorophenyl)methyl]acetamide CAS Name: 2-[ethyl-[1-oxo-2-(2-quinolinylthio)ethyl]amino]-N-[(4-fluorophenyl)methyl]acetamide IUPAC Name: 2-[ethyl-(2-quinolin-2-ylsulfanylacetyl)amino]-N-[(4-fluorophenyl)methyl]acetamide Traditional Name: 2-[ethyl-[2-(2-quinolylthio)acetyl]amino]-N-(4-fluorobenzyl)acetamide Formula: C22H22FN3O2S MolecularWeight: 411.492383

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NCC1=CC=C(C=C1)F)C(=O)CSC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCN(CC(=O)NCC1=CC=C(C=C1)F)C(=O)CSC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H22FN3O2S/c1-2-26(14-20(27)24-13-16-7-10-18(23)11-8-16)22(28)15-29-21-12-9-17-5-3-4-6-19(17)25-21/h3-12H,2,13-15H2,1H3,(H,24,27)