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

Systemtic Name: 2-[1-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]sulfanylpropanenitrile Openeye Name: 2-[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanylpropanenitrile CAS Name: 2-[[1-(phenylmethyl)-5-(trifluoromethyl)-2-benzimidazolyl]thio]propanenitrile IUPAC Name: 2-[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanylpropanenitrile Traditional Name: 2-[[1-benzyl-5-(trifluoromethyl)benzimidazol-2-yl]thio]propionitrile Formula: C18H14F3N3S MolecularWeight: 361.38407

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)SC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)C(F)(F)F

Isomeric SMILES

CC(C#N)SC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)C(F)(F)F

InChI

InChI=1S/C18H14F3N3S/c1-12(10-22)25-17-23-15-9-14(18(19,20)21)7-8-16(15)24(17)11-13-5-3-2-4-6-13/h2-9,12H,11H2,1H3