3-nitro-4-[[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanylmethyl]benzamide

Systemtic Name: 3-nitro-4-[[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanylmethyl]benzamide Openeye Name: 3-nitro-4-[[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanylmethyl]benzamide CAS Name: 3-nitro-4-[[[1-propyl-6-(trifluoromethyl)-2-benzimidazolyl]thio]methyl]benzamide IUPAC Name: 3-nitro-4-[[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanylmethyl]benzamide Traditional Name: 3-nitro-4-[[[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]thio]methyl]benzamide Formula: C19H17F3N4O3S MolecularWeight: 438.42349

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=CC(=C2)C(F)(F)F)N=C1SCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCCN1C2=C(C=CC(=C2)C(F)(F)F)N=C1SCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C19H17F3N4O3S/c1-2-7-25-16-9-13(19(20,21)22)5-6-14(16)24-18(25)30-10-12-4-3-11(17(23)27)8-15(12)26(28)29/h3-6,8-9H,2,7,10H2,1H3,(H2,23,27)