[2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] 3-fluoranylbenzoate

Systemtic Name: [2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxidanylidene-ethyl] 3-fluoranylbenzoate Openeye Name: [2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxo-ethyl] 3-fluorobenzoate CAS Name: 3-fluorobenzoic acid [2-[2-[(4-bromophenyl)thio]ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxoethyl] 3-fluorobenzoate Traditional Name: 3-fluorobenzoic acid [2-[2-[(4-bromophenyl)thio]ethylamino]-2-keto-ethyl] ester Formula: C17H15BrFNO3S MolecularWeight: 412.273303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)C(=O)OCC(=O)NCCSC2=CC=C(C=C2)Br

Isomeric SMILES

C1=CC(=CC(=C1)F)C(=O)OCC(=O)NCCSC2=CC=C(C=C2)Br

InChI

InChI=1S/C17H15BrFNO3S/c18-13-4-6-15(7-5-13)24-9-8-20-16(21)11-23-17(22)12-2-1-3-14(19)10-12/h1-7,10H,8-9,11H2,(H,20,21)