[(2R)-1-[[2,6-bis(fluoranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 4-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [(2R)-1-[[2,6-bis(fluoranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 4-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: [(1R)-2-(2,6-difluoroanilino)-1-methyl-2-oxo-ethyl] 4-fluorobenzothiophene-2-carboxylate CAS Name: 4-fluoro-1-benzothiophene-2-carboxylic acid [(2R)-1-(2,6-difluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2,6-difluoroanilino)-1-oxopropan-2-yl] 4-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 4-fluorobenzothiophene-2-carboxylic acid [(1R)-2-(2,6-difluoroanilino)-2-keto-1-methyl-ethyl] ester Formula: C18H12F3NO3S MolecularWeight: 379.35299

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC=C1F)F)OC(=O)C2=CC3=C(C=CC=C3S2)F

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=CC=C1F)F)OC(=O)C2=CC3=C(C=CC=C3S2)F

InChI

InChI=1S/C18H12F3NO3S/c1-9(17(23)22-16-12(20)5-2-6-13(16)21)25-18(24)15-8-10-11(19)4-3-7-14(10)26-15/h2-9H,1H3,(H,22,23)/t9-/m1/s1