2-bromanyl-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-fluoranyl-benzamide

Systemtic Name: 2-bromanyl-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-fluoranyl-benzamide Openeye Name: 2-bromo-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-fluoro-benzamide CAS Name: 2-bromo-N-[2-[(2-cyanophenyl)methylthio]ethyl]-4-fluorobenzamide IUPAC Name: 2-bromo-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-fluorobenzamide Traditional Name: 2-bromo-N-[2-[(2-cyanobenzyl)thio]ethyl]-4-fluoro-benzamide Formula: C17H14BrFN2OS MolecularWeight: 393.273263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC(=O)C2=C(C=C(C=C2)F)Br)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC(=O)C2=C(C=C(C=C2)F)Br)C#N

InChI

InChI=1S/C17H14BrFN2OS/c18-16-9-14(19)5-6-15(16)17(22)21-7-8-23-11-13-4-2-1-3-12(13)10-20/h1-6,9H,7-8,11H2,(H,21,22)