5-(2-fluorophenyl)-3-[(2-phenoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-(2-fluorophenyl)-3-[(2-phenoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(2-fluorophenyl)-3-[(2-phenoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-(2-fluorophenyl)-3-[(2-phenoxyphenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-(2-fluorophenyl)-3-[(2-phenoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(2-fluorophenyl)-3-[(2-phenoxybenzyl)thio]-1H-1,2,4-triazole Formula: C21H16FN3OS MolecularWeight: 377.434643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC=C2CSC3=NNC(=N3)C4=CC=CC=C4F

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC=C2CSC3=NNC(=N3)C4=CC=CC=C4F

InChI

InChI=1S/C21H16FN3OS/c22-18-12-6-5-11-17(18)20-23-21(25-24-20)27-14-15-8-4-7-13-19(15)26-16-9-2-1-3-10-16/h1-13H,14H2,(H,23,24,25)