N-(2-cyano-3,5-dimethyl-phenyl)-2-[(4-fluorophenyl)methylsulfanyl]benzamide

Systemtic Name: N-(2-cyano-3,5-dimethyl-phenyl)-2-[(4-fluorophenyl)methylsulfanyl]benzamide Openeye Name: N-(2-cyano-3,5-dimethyl-phenyl)-2-[(4-fluorophenyl)methylsulfanyl]benzamide CAS Name: N-(2-cyano-3,5-dimethylphenyl)-2-[(4-fluorophenyl)methylthio]benzamide IUPAC Name: N-(2-cyano-3,5-dimethylphenyl)-2-[(4-fluorophenyl)methylsulfanyl]benzamide Traditional Name: N-(2-cyano-3,5-dimethyl-phenyl)-2-[(4-fluorobenzyl)thio]benzamide Formula: C23H19FN2OS MolecularWeight: 390.473163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)NC(=O)C2=CC=CC=C2SCC3=CC=C(C=C3)F)C#N)C

Isomeric SMILES

CC1=CC(=C(C(=C1)NC(=O)C2=CC=CC=C2SCC3=CC=C(C=C3)F)C#N)C

InChI

InChI=1S/C23H19FN2OS/c1-15-11-16(2)20(13-25)21(12-15)26-23(27)19-5-3-4-6-22(19)28-14-17-7-9-18(24)10-8-17/h3-12H,14H2,1-2H3,(H,26,27)