4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[2,3,4-tris(fluoranyl)phenyl]benzamide

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[2,3,4-tris(fluoranyl)phenyl]benzamide Openeye Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-(2,3,4-trifluorophenyl)benzamide CAS Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-(2,3,4-trifluorophenyl)benzamide IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-(2,3,4-trifluorophenyl)benzamide Traditional Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-(2,3,4-trifluorophenyl)benzamide Formula: C21H14F3N3OS MolecularWeight: 413.41557

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCC3=CC=C(C=C3)C(=O)NC4=C(C(=C(C=C4)F)F)F

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCC3=CC=C(C=C3)C(=O)NC4=C(C(=C(C=C4)F)F)F

InChI

InChI=1S/C21H14F3N3OS/c22-14-9-10-17(19(24)18(14)23)25-20(28)13-7-5-12(6-8-13)11-29-21-26-15-3-1-2-4-16(15)27-21/h1-10H,11H2,(H,25,28)(H,26,27)