[2-oxidanylidene-2-[(2-propan-2-ylphenyl)amino]ethyl] 4-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(2-propan-2-ylphenyl)amino]ethyl] 4-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: [2-(2-isopropylanilino)-2-oxo-ethyl] 4-fluorobenzothiophene-2-carboxylate CAS Name: 4-fluoro-1-benzothiophene-2-carboxylic acid [2-oxo-2-(2-propan-2-ylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2-propan-2-ylanilino)ethyl] 4-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 4-fluorobenzothiophene-2-carboxylic acid [2-(2-isopropylanilino)-2-keto-ethyl] ester Formula: C20H18FNO3S MolecularWeight: 371.425223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)COC(=O)C2=CC3=C(C=CC=C3S2)F

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=O)COC(=O)C2=CC3=C(C=CC=C3S2)F

InChI

InChI=1S/C20H18FNO3S/c1-12(2)13-6-3-4-8-16(13)22-19(23)11-25-20(24)18-10-14-15(21)7-5-9-17(14)26-18/h3-10,12H,11H2,1-2H3,(H,22,23)