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

Systemtic Name: ethyl 3-[[(4-ethanoylphenyl)amino]methyl]-4-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: ethyl 3-[(4-acetylanilino)methyl]-4-fluoro-benzothiophene-2-carboxylate CAS Name: 3-[(4-acetylanilino)methyl]-4-fluoro-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[(4-acetylanilino)methyl]-4-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 3-[(4-acetylanilino)methyl]-4-fluoro-benzothiophene-2-carboxylic acid ethyl ester Formula: C20H18FNO3S MolecularWeight: 371.425223

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CNC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CNC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C20H18FNO3S/c1-3-25-20(24)19-15(18-16(21)5-4-6-17(18)26-19)11-22-14-9-7-13(8-10-14)12(2)23/h4-10,22H,3,11H2,1-2H3