1-phenyl-4-[1-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-butan-1-one

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)C(F)(F)F)N=C2SCCCC(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)C(F)(F)F)N=C2SCCCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H21F3N2OS/c26-25(27,28)20-13-14-22-21(16-20)29-24(30(22)17-18-8-3-1-4-9-18)32-15-7-12-23(31)19-10-5-2-6-11-19/h1-6,8-11,13-14,16H,7,12,15,17H2