2-[(4-tert-butylphenyl)methylsulfanyl]-1-(phenylmethyl)-5-(trifluoromethyl)benzimidazole

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-1-(phenylmethyl)-5-(trifluoromethyl)benzimidazole Openeye Name: 1-benzyl-2-[(4-tert-butylphenyl)methylsulfanyl]-5-(trifluoromethyl)benzimidazole CAS Name: 2-[(4-tert-butylphenyl)methylthio]-1-(phenylmethyl)-5-(trifluoromethyl)benzimidazole IUPAC Name: 1-benzyl-2-[(4-tert-butylphenyl)methylsulfanyl]-5-(trifluoromethyl)benzimidazole Traditional Name: 1-benzyl-2-[(4-tert-butylbenzyl)thio]-5-(trifluoromethyl)benzimidazole Formula: C26H25F3N2S MolecularWeight: 454.55031

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H25F3N2S/c1-25(2,3)20-11-9-19(10-12-20)17-32-24-30-22-15-21(26(27,28)29)13-14-23(22)31(24)16-18-7-5-4-6-8-18/h4-15H,16-17H2,1-3H3