N-(2-methyl-6-nitro-phenyl)-2-[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-methyl-6-nitro-phenyl)-2-[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(2-methyl-6-nitro-phenyl)-2-[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-acetamide CAS Name: N-(2-methyl-6-nitrophenyl)-2-[[1-propyl-6-(trifluoromethyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-(2-methyl-6-nitrophenyl)-2-[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: N-(2-methyl-6-nitro-phenyl)-2-[[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]thio]acetamide Formula: C20H19F3N4O3S MolecularWeight: 452.45007

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=CC(=C2)C(F)(F)F)N=C1SCC(=O)NC3=C(C=CC=C3[N+](=O)[O-])C

Isomeric SMILES

CCCN1C2=C(C=CC(=C2)C(F)(F)F)N=C1SCC(=O)NC3=C(C=CC=C3[N+](=O)[O-])C

InChI

InChI=1S/C20H19F3N4O3S/c1-3-9-26-16-10-13(20(21,22)23)7-8-14(16)24-19(26)31-11-17(28)25-18-12(2)5-4-6-15(18)27(29)30/h4-8,10H,3,9,11H2,1-2H3,(H,25,28)