3-[[2,5-bis(fluoranyl)phenyl]methylsulfanyl]-5-methyl-4-phenyl-1,2,4-triazole

Systemtic Name: 3-[[2,5-bis(fluoranyl)phenyl]methylsulfanyl]-5-methyl-4-phenyl-1,2,4-triazole Openeye Name: 3-[(2,5-difluorophenyl)methylsulfanyl]-5-methyl-4-phenyl-1,2,4-triazole CAS Name: 3-[(2,5-difluorophenyl)methylthio]-5-methyl-4-phenyl-1,2,4-triazole IUPAC Name: 3-[(2,5-difluorophenyl)methylsulfanyl]-5-methyl-4-phenyl-1,2,4-triazole Traditional Name: 3-[(2,5-difluorobenzyl)thio]-5-methyl-4-phenyl-1,2,4-triazole Formula: C16H13F2N3S MolecularWeight: 317.356326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC=C2)SCC3=C(C=CC(=C3)F)F

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2)SCC3=C(C=CC(=C3)F)F

InChI

InChI=1S/C16H13F2N3S/c1-11-19-20-16(21(11)14-5-3-2-4-6-14)22-10-12-9-13(17)7-8-15(12)18/h2-9H,10H2,1H3