3-(2-fluorophenyl)-4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 3-(2-fluorophenyl)-4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-5-(2-fluorophenyl)-4-methyl-1,2,4-triazole CAS Name: 3-(2-fluorophenyl)-4-methyl-5-(phenylmethylthio)-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-5-(2-fluorophenyl)-4-methyl-1,2,4-triazole Traditional Name: 3-(benzylthio)-5-(2-fluorophenyl)-4-methyl-1,2,4-triazole Formula: C16H14FN3S MolecularWeight: 299.365863

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC=C2)C3=CC=CC=C3F

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC=C2)C3=CC=CC=C3F

InChI

InChI=1S/C16H14FN3S/c1-20-15(13-9-5-6-10-14(13)17)18-19-16(20)21-11-12-7-3-2-4-8-12/h2-10H,11H2,1H3