[2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: [2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] 4-fluorobenzothiophene-2-carboxylate CAS Name: 4-fluoro-1-benzothiophene-2-carboxylic acid [2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxo-1-phenylethyl] 4-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 4-fluorobenzothiophene-2-carboxylic acid [2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C20H16FNO3S MolecularWeight: 369.409343

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C(C2=CC=CC=C2)OC(=O)C3=CC4=C(C=CC=C4S3)F

Isomeric SMILES

C1CC1NC(=O)C(C2=CC=CC=C2)OC(=O)C3=CC4=C(C=CC=C4S3)F

InChI

InChI=1S/C20H16FNO3S/c21-15-7-4-8-16-14(15)11-17(26-16)20(24)25-18(12-5-2-1-3-6-12)19(23)22-13-9-10-13/h1-8,11,13,18H,9-10H2,(H,22,23)