[1-[[2,6-bis(fluoranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 4-azanyl-3-methylsulfanyl-benzoate

Systemtic Name: [1-[[2,6-bis(fluoranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 4-azanyl-3-methylsulfanyl-benzoate Openeye Name: [2-(2,6-difluoroanilino)-1-methyl-2-oxo-ethyl] 4-amino-3-methylsulfanyl-benzoate CAS Name: 4-amino-3-(methylthio)benzoic acid [1-(2,6-difluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,6-difluoroanilino)-1-oxopropan-2-yl] 4-amino-3-methylsulfanylbenzoate Traditional Name: 4-amino-3-(methylthio)benzoic acid [2-(2,6-difluoroanilino)-2-keto-1-methyl-ethyl] ester Formula: C17H16F2N2O3S MolecularWeight: 366.382346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC=C1F)F)OC(=O)C2=CC(=C(C=C2)N)SC

Isomeric SMILES

CC(C(=O)NC1=C(C=CC=C1F)F)OC(=O)C2=CC(=C(C=C2)N)SC

InChI

InChI=1S/C17H16F2N2O3S/c1-9(16(22)21-15-11(18)4-3-5-12(15)19)24-17(23)10-6-7-13(20)14(8-10)25-2/h3-9H,20H2,1-2H3,(H,21,22)