ethyl 4-fluoranyl-3-[[[(1R)-1-phenylethyl]amino]methyl]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 4-fluoranyl-3-[[[(1R)-1-phenylethyl]amino]methyl]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 4-fluoro-3-[[[(1R)-1-phenylethyl]amino]methyl]benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-[[[(1R)-1-phenylethyl]amino]methyl]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-fluoro-3-[[[(1R)-1-phenylethyl]amino]methyl]-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-[[[(1R)-1-phenylethyl]amino]methyl]benzothiophene-2-carboxylic acid ethyl ester Formula: C20H20FNO2S MolecularWeight: 357.441703

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CNC(C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CN[C@H](C)C3=CC=CC=C3

InChI

InChI=1S/C20H20FNO2S/c1-3-24-20(23)19-15(18-16(21)10-7-11-17(18)25-19)12-22-13(2)14-8-5-4-6-9-14/h4-11,13,22H,3,12H2,1-2H3/t13-/m1/s1