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

Systemtic Name: ethyl 3-[[(2-aminocarbonylphenyl)amino]methyl]-4-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: ethyl 3-[(2-carbamoylanilino)methyl]-4-fluoro-benzothiophene-2-carboxylate CAS Name: 3-[(2-carbamoylanilino)methyl]-4-fluoro-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[(2-carbamoylanilino)methyl]-4-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 3-[(2-carbamoylanilino)methyl]-4-fluoro-benzothiophene-2-carboxylic acid ethyl ester Formula: C19H17FN2O3S MolecularWeight: 372.413283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CNC3=CC=CC=C3C(=O)N

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CNC3=CC=CC=C3C(=O)N

InChI

InChI=1S/C19H17FN2O3S/c1-2-25-19(24)17-12(16-13(20)7-5-9-15(16)26-17)10-22-14-8-4-3-6-11(14)18(21)23/h3-9,22H,2,10H2,1H3,(H2,21,23)