3-[(2-fluorophenyl)methylsulfanyl]-5-methyl-4-(4-methylphenyl)-1,2,4-triazole

Systemtic Name: 3-[(2-fluorophenyl)methylsulfanyl]-5-methyl-4-(4-methylphenyl)-1,2,4-triazole Openeye Name: 3-[(2-fluorophenyl)methylsulfanyl]-5-methyl-4-(p-tolyl)-1,2,4-triazole CAS Name: 3-[(2-fluorophenyl)methylthio]-5-methyl-4-(4-methylphenyl)-1,2,4-triazole IUPAC Name: 3-[(2-fluorophenyl)methylsulfanyl]-5-methyl-4-(4-methylphenyl)-1,2,4-triazole Traditional Name: 3-[(2-fluorobenzyl)thio]-5-methyl-4-(p-tolyl)-1,2,4-triazole Formula: C17H16FN3S MolecularWeight: 313.392443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3F)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3F)C

InChI

InChI=1S/C17H16FN3S/c1-12-7-9-15(10-8-12)21-13(2)19-20-17(21)22-11-14-5-3-4-6-16(14)18/h3-10H,11H2,1-2H3