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

Systemtic Name: 3-[[2,6-bis(fluoranyl)phenyl]methylsulfanyl]-5-methyl-4-phenyl-1,2,4-triazole Openeye Name: 3-[(2,6-difluorophenyl)methylsulfanyl]-5-methyl-4-phenyl-1,2,4-triazole CAS Name: 3-[(2,6-difluorophenyl)methylthio]-5-methyl-4-phenyl-1,2,4-triazole IUPAC Name: 3-[(2,6-difluorophenyl)methylsulfanyl]-5-methyl-4-phenyl-1,2,4-triazole Traditional Name: 3-[(2,6-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=C3F)F

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2)SCC3=C(C=CC=C3F)F

InChI

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