4-bromanyl-N-[2-[2,2,2-tris(fluoranyl)ethylsulfanyl]phenyl]benzamide

Systemtic Name: 4-bromanyl-N-[2-[2,2,2-tris(fluoranyl)ethylsulfanyl]phenyl]benzamide Openeye Name: 4-bromo-N-[2-(2,2,2-trifluoroethylsulfanyl)phenyl]benzamide CAS Name: 4-bromo-N-[2-(2,2,2-trifluoroethylthio)phenyl]benzamide IUPAC Name: 4-bromo-N-[2-(2,2,2-trifluoroethylsulfanyl)phenyl]benzamide Traditional Name: 4-bromo-N-[2-(2,2,2-trifluoroethylthio)phenyl]benzamide Formula: C15H11BrF3NOS MolecularWeight: 390.21815

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)C2=CC=C(C=C2)Br)SCC(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)C2=CC=C(C=C2)Br)SCC(F)(F)F

InChI

InChI=1S/C15H11BrF3NOS/c16-11-7-5-10(6-8-11)14(21)20-12-3-1-2-4-13(12)22-9-15(17,18)19/h1-8H,9H2,(H,20,21)