N-[4-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-4-fluoranyl-benzamide

Systemtic Name: N-[4-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-4-fluoranyl-benzamide Openeye Name: N-[4-[2-(2-bromoanilino)-2-oxo-ethyl]sulfanylphenyl]-4-fluoro-benzamide CAS Name: N-[4-[[2-(2-bromoanilino)-2-oxoethyl]thio]phenyl]-4-fluorobenzamide IUPAC Name: N-[4-[2-(2-bromoanilino)-2-oxoethyl]sulfanylphenyl]-4-fluorobenzamide Traditional Name: N-[4-[[2-(2-bromoanilino)-2-keto-ethyl]thio]phenyl]-4-fluoro-benzamide Formula: C21H16BrFN2O2S MolecularWeight: 459.331343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CSC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)F)Br

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CSC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)F)Br

InChI

InChI=1S/C21H16BrFN2O2S/c22-18-3-1-2-4-19(18)25-20(26)13-28-17-11-9-16(10-12-17)24-21(27)14-5-7-15(23)8-6-14/h1-12H,13H2,(H,24,27)(H,25,26)