1-(4-ethylphenyl)-2-[1-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(4-ethylphenyl)-2-[1-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-ethanone Openeye Name: 2-[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-1-(4-ethylphenyl)ethanone CAS Name: 1-(4-ethylphenyl)-2-[[1-(phenylmethyl)-5-(trifluoromethyl)-2-benzimidazolyl]thio]ethanone IUPAC Name: 2-[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-1-(4-ethylphenyl)ethanone Traditional Name: 2-[[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]thio]-1-(4-ethylphenyl)ethanone Formula: C25H21F3N2OS MolecularWeight: 454.50725

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)CSC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)C(F)(F)F

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)CSC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)C(F)(F)F

InChI

InChI=1S/C25H21F3N2OS/c1-2-17-8-10-19(11-9-17)23(31)16-32-24-29-21-14-20(25(26,27)28)12-13-22(21)30(24)15-18-6-4-3-5-7-18/h3-14H,2,15-16H2,1H3