N-[[7-(5-ethanoylthiophen-2-yl)-5-fluoranyl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-methyl-4-oxidanylidene-pentanamide

Systemtic Name: N-[[7-(5-ethanoylthiophen-2-yl)-5-fluoranyl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-methyl-4-oxidanylidene-pentanamide Openeye Name: N-[[7-(5-acetyl-2-thienyl)-5-fluoro-2,3-dihydrobenzofuran-2-yl]methyl]-2-methyl-4-oxo-pentanamide CAS Name: N-[[7-(5-acetyl-2-thiophenyl)-5-fluoro-2,3-dihydrobenzofuran-2-yl]methyl]-2-methyl-4-oxopentanamide IUPAC Name: N-[[7-(5-acetylthiophen-2-yl)-5-fluoro-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-methyl-4-oxopentanamide Traditional Name: N-[[7-(5-acetyl-2-thienyl)-5-fluoro-coumaran-2-yl]methyl]-4-keto-2-methyl-valeramide Formula: C21H22FNO4S MolecularWeight: 403.467083

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C)C(=O)NCC1CC2=C(O1)C(=CC(=C2)F)C3=CC=C(S3)C(=O)C

Isomeric SMILES

CC(CC(=O)C)C(=O)NCC1CC2=C(O1)C(=CC(=C2)F)C3=CC=C(S3)C(=O)C

InChI

InChI=1S/C21H22FNO4S/c1-11(6-12(2)24)21(26)23-10-16-8-14-7-15(22)9-17(20(14)27-16)19-5-4-18(28-19)13(3)25/h4-5,7,9,11,16H,6,8,10H2,1-3H3,(H,23,26)