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

Systemtic Name: 3-[[2,6-bis(fluoranyl)phenyl]methylsulfanyl]-4-methyl-5-thiophen-2-yl-1,2,4-triazole Openeye Name: 3-[(2,6-difluorophenyl)methylsulfanyl]-4-methyl-5-(2-thienyl)-1,2,4-triazole CAS Name: 3-[(2,6-difluorophenyl)methylthio]-4-methyl-5-thiophen-2-yl-1,2,4-triazole IUPAC Name: 3-[(2,6-difluorophenyl)methylsulfanyl]-4-methyl-5-thiophen-2-yl-1,2,4-triazole Traditional Name: 3-[(2,6-difluorobenzyl)thio]-4-methyl-5-(2-thienyl)-1,2,4-triazole Formula: C14H11F2N3S2 MolecularWeight: 323.384046

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=C(C=CC=C2F)F)C3=CC=CS3

Isomeric SMILES

CN1C(=NN=C1SCC2=C(C=CC=C2F)F)C3=CC=CS3

InChI

InChI=1S/C14H11F2N3S2/c1-19-13(12-6-3-7-20-12)17-18-14(19)21-8-9-10(15)4-2-5-11(9)16/h2-7H,8H2,1H3