[(2R)-1-oxidanylidene-1-[(2,4,6-trimethylphenyl)amino]propan-2-yl] 4-fluoranyl-3-methyl-1-benzothiophene-2-carboxylate

Systemtic Name: [(2R)-1-oxidanylidene-1-[(2,4,6-trimethylphenyl)amino]propan-2-yl] 4-fluoranyl-3-methyl-1-benzothiophene-2-carboxylate Openeye Name: [(1R)-1-methyl-2-oxo-2-(2,4,6-trimethylanilino)ethyl] 4-fluoro-3-methyl-benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-methyl-1-benzothiophene-2-carboxylic acid [(2R)-1-oxo-1-(2,4,6-trimethylanilino)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(2,4,6-trimethylanilino)propan-2-yl] 4-fluoro-3-methyl-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-methyl-benzothiophene-2-carboxylic acid [(1R)-2-keto-2-mesidino-1-methyl-ethyl] ester Formula: C22H22FNO3S MolecularWeight: 399.478383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C(C)OC(=O)C2=C(C3=C(C=CC=C3S2)F)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)[C@@H](C)OC(=O)C2=C(C3=C(C=CC=C3S2)F)C)C

InChI

InChI=1S/C22H22FNO3S/c1-11-9-12(2)19(13(3)10-11)24-21(25)15(5)27-22(26)20-14(4)18-16(23)7-6-8-17(18)28-20/h6-10,15H,1-5H3,(H,24,25)/t15-/m1/s1