3-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-(4-chlorophenyl)-5-phenyl-1,2,4-triazole

Systemtic Name: 3-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-(4-chlorophenyl)-5-phenyl-1,2,4-triazole Openeye Name: 3-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-4-(4-chlorophenyl)-5-phenyl-1,2,4-triazole CAS Name: 3-[(2-chloro-6-fluorophenyl)methylthio]-4-(4-chlorophenyl)-5-phenyl-1,2,4-triazole IUPAC Name: 3-[(2-chloro-6-fluorophenyl)methylsulfanyl]-4-(4-chlorophenyl)-5-phenyl-1,2,4-triazole Traditional Name: 3-[(2-chloro-6-fluoro-benzyl)thio]-4-(4-chlorophenyl)-5-phenyl-1,2,4-triazole Formula: C21H14Cl2FN3S MolecularWeight: 430.325363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC4=C(C=CC=C4Cl)F

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C21H14Cl2FN3S/c22-15-9-11-16(12-10-15)27-20(14-5-2-1-3-6-14)25-26-21(27)28-13-17-18(23)7-4-8-19(17)24/h1-12H,13H2