3-(2-methoxyphenyl)-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-4-phenyl-1,2,4-triazole

Systemtic Name: 3-(2-methoxyphenyl)-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-4-phenyl-1,2,4-triazole Openeye Name: 3-(2-methoxyphenyl)-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-4-phenyl-1,2,4-triazole CAS Name: 3-(2-methoxyphenyl)-5-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-4-phenyl-1,2,4-triazole IUPAC Name: 3-(2-methoxyphenyl)-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-4-phenyl-1,2,4-triazole Traditional Name: 3-(2-methoxyphenyl)-5-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-4-phenyl-1,2,4-triazole Formula: C22H15F3N4O3S MolecularWeight: 472.43971

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN=C(N2C3=CC=CC=C3)SC4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1C2=NN=C(N2C3=CC=CC=C3)SC4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C22H15F3N4O3S/c1-32-18-10-6-5-9-16(18)20-26-27-21(28(20)15-7-3-2-4-8-15)33-19-12-11-14(22(23,24)25)13-17(19)29(30)31/h2-13H,1H3