5-(4-chlorophenyl)-1-methyl-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-imidazole

Systemtic Name: 5-(4-chlorophenyl)-1-methyl-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-imidazole Openeye Name: 5-(4-chlorophenyl)-1-methyl-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-imidazole CAS Name: 5-(4-chlorophenyl)-1-methyl-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]imidazole IUPAC Name: 5-(4-chlorophenyl)-1-methyl-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylimidazole Traditional Name: 5-(4-chlorophenyl)-1-methyl-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]imidazole Formula: C17H11ClF3N3O2S MolecularWeight: 413.80135

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1SC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C3=CC=C(C=C3)Cl

Isomeric SMILES

CN1C(=CN=C1SC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H11ClF3N3O2S/c1-23-14(10-2-5-12(18)6-3-10)9-22-16(23)27-15-7-4-11(17(19,20)21)8-13(15)24(25)26/h2-9H,1H3