[2-[[2,5-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl] 3-methyl-1-benzothiophene-2-carboxylate

Systemtic Name: [2-[[2,5-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl] 3-methyl-1-benzothiophene-2-carboxylate Openeye Name: [2-(2,5-difluoroanilino)-2-oxo-ethyl] 3-methylbenzothiophene-2-carboxylate CAS Name: 3-methyl-1-benzothiophene-2-carboxylic acid [2-(2,5-difluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,5-difluoroanilino)-2-oxoethyl] 3-methyl-1-benzothiophene-2-carboxylate Traditional Name: 3-methylbenzothiophene-2-carboxylic acid [2-(2,5-difluoroanilino)-2-keto-ethyl] ester Formula: C18H13F2NO3S MolecularWeight: 361.362526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)OCC(=O)NC3=C(C=CC(=C3)F)F

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)OCC(=O)NC3=C(C=CC(=C3)F)F

InChI

InChI=1S/C18H13F2NO3S/c1-10-12-4-2-3-5-15(12)25-17(10)18(23)24-9-16(22)21-14-8-11(19)6-7-13(14)20/h2-8H,9H2,1H3,(H,21,22)