N-[[(2R)-7-(5-ethanoylthiophen-2-yl)-5-fluoranyl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-ethyl-butanamide

Systemtic Name: N-[[(2R)-7-(5-ethanoylthiophen-2-yl)-5-fluoranyl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-ethyl-butanamide Openeye Name: N-[[(2R)-7-(5-acetyl-2-thienyl)-5-fluoro-2,3-dihydrobenzofuran-2-yl]methyl]-2-ethyl-butanamide CAS Name: N-[[(2R)-7-(5-acetyl-2-thiophenyl)-5-fluoro-2,3-dihydrobenzofuran-2-yl]methyl]-2-ethylbutanamide IUPAC Name: N-[[(2R)-7-(5-acetylthiophen-2-yl)-5-fluoro-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-ethylbutanamide Traditional Name: N-[[(2R)-7-(5-acetyl-2-thienyl)-5-fluoro-coumaran-2-yl]methyl]-2-ethyl-butyramide Formula: C21H24FNO3S MolecularWeight: 389.483563

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC(CC)C(=O)NC[C@H]1CC2=C(O1)C(=CC(=C2)F)C3=CC=C(S3)C(=O)C

InChI

InChI=1S/C21H24FNO3S/c1-4-13(5-2)21(25)23-11-16-9-14-8-15(22)10-17(20(14)26-16)19-7-6-18(27-19)12(3)24/h6-8,10,13,16H,4-5,9,11H2,1-3H3,(H,23,25)/t16-/m1/s1