2-[2-(4-methoxyphenyl)ethylsulfanyl]-1-(phenylmethyl)-5-(trifluoromethyl)benzimidazole

Systemtic Name: 2-[2-(4-methoxyphenyl)ethylsulfanyl]-1-(phenylmethyl)-5-(trifluoromethyl)benzimidazole Openeye Name: 1-benzyl-2-[2-(4-methoxyphenyl)ethylsulfanyl]-5-(trifluoromethyl)benzimidazole CAS Name: 2-[2-(4-methoxyphenyl)ethylthio]-1-(phenylmethyl)-5-(trifluoromethyl)benzimidazole IUPAC Name: 1-benzyl-2-[2-(4-methoxyphenyl)ethylsulfanyl]-5-(trifluoromethyl)benzimidazole Traditional Name: 1-benzyl-2-[2-(4-methoxyphenyl)ethylthio]-5-(trifluoromethyl)benzimidazole Formula: C24H21F3N2OS MolecularWeight: 442.49655

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCSC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)CCSC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)C(F)(F)F

InChI

InChI=1S/C24H21F3N2OS/c1-30-20-10-7-17(8-11-20)13-14-31-23-28-21-15-19(24(25,26)27)9-12-22(21)29(23)16-18-5-3-2-4-6-18/h2-12,15H,13-14,16H2,1H3