1-(3-nitrophenyl)-2-[1-propan-2-yl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(3-nitrophenyl)-2-[1-propan-2-yl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-ethanone Openeye Name: 2-[1-isopropyl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanyl-1-(3-nitrophenyl)ethanone CAS Name: 1-(3-nitrophenyl)-2-[[1-propan-2-yl-5-(trifluoromethyl)-2-benzimidazolyl]thio]ethanone IUPAC Name: 1-(3-nitrophenyl)-2-[1-propan-2-yl-5-(trifluoromethyl)benzimidazol-2-yl]sulfanylethanone Traditional Name: 2-[[1-isopropyl-5-(trifluoromethyl)benzimidazol-2-yl]thio]-1-(3-nitrophenyl)ethanone Formula: C19H16F3N3O3S MolecularWeight: 423.40885

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=C(C=C2)C(F)(F)F)N=C1SCC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)N1C2=C(C=C(C=C2)C(F)(F)F)N=C1SCC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H16F3N3O3S/c1-11(2)24-16-7-6-13(19(20,21)22)9-15(16)23-18(24)29-10-17(26)12-4-3-5-14(8-12)25(27)28/h3-9,11H,10H2,1-2H3