N-(2-cyanophenyl)-3-[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-propanamide

Systemtic Name: N-(2-cyanophenyl)-3-[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-propanamide Openeye Name: N-(2-cyanophenyl)-3-[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-propanamide CAS Name: N-(2-cyanophenyl)-3-[[1-propyl-6-(trifluoromethyl)-2-benzimidazolyl]thio]propanamide IUPAC Name: N-(2-cyanophenyl)-3-[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanylpropanamide Traditional Name: N-(2-cyanophenyl)-3-[[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]thio]propionamide Formula: C21H19F3N4OS MolecularWeight: 432.46197

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=CC(=C2)C(F)(F)F)N=C1SCCC(=O)NC3=CC=CC=C3C#N

Isomeric SMILES

CCCN1C2=C(C=CC(=C2)C(F)(F)F)N=C1SCCC(=O)NC3=CC=CC=C3C#N

InChI

InChI=1S/C21H19F3N4OS/c1-2-10-28-18-12-15(21(22,23)24)7-8-17(18)27-20(28)30-11-9-19(29)26-16-6-4-3-5-14(16)13-25/h3-8,12H,2,9-11H2,1H3,(H,26,29)