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

Systemtic Name: N-[4-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanylphenyl]-2-fluoranyl-benzamide Openeye Name: N-[4-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanylphenyl]-2-fluoro-benzamide CAS Name: N-[4-[[2-(4-bromophenyl)-2-oxoethyl]thio]phenyl]-2-fluorobenzamide IUPAC Name: N-[4-[2-(4-bromophenyl)-2-oxoethyl]sulfanylphenyl]-2-fluorobenzamide Traditional Name: N-[4-[[2-(4-bromophenyl)-2-keto-ethyl]thio]phenyl]-2-fluoro-benzamide Formula: C21H15BrFNO2S MolecularWeight: 444.316703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)SCC(=O)C3=CC=C(C=C3)Br)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)SCC(=O)C3=CC=C(C=C3)Br)F

InChI

InChI=1S/C21H15BrFNO2S/c22-15-7-5-14(6-8-15)20(25)13-27-17-11-9-16(10-12-17)24-21(26)18-3-1-2-4-19(18)23/h1-12H,13H2,(H,24,26)