2-[[1-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 2-[[1-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 2-[[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanylmethyl]benzonitrile CAS Name: 2-[[[1-(phenylmethyl)-5-(trifluoromethyl)-2-benzimidazolyl]thio]methyl]benzonitrile IUPAC Name: 2-[[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 2-[[[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]thio]methyl]benzonitrile Formula: C23H16F3N3S MolecularWeight: 423.45345

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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=C2SCC4=CC=CC=C4C#N

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)C(F)(F)F)N=C2SCC4=CC=CC=C4C#N

InChI

InChI=1S/C23H16F3N3S/c24-23(25,26)19-10-11-21-20(12-19)28-22(29(21)14-16-6-2-1-3-7-16)30-15-18-9-5-4-8-17(18)13-27/h1-12H,14-15H2