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

Systemtic Name: 3-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-methyl-5-(2-methylphenyl)-1,2,4-triazole Openeye Name: 3-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-4-methyl-5-(o-tolyl)-1,2,4-triazole CAS Name: 3-[(2-chloro-6-fluorophenyl)methylthio]-4-methyl-5-(2-methylphenyl)-1,2,4-triazole IUPAC Name: 3-[(2-chloro-6-fluorophenyl)methylsulfanyl]-4-methyl-5-(2-methylphenyl)-1,2,4-triazole Traditional Name: 3-[(2-chloro-6-fluoro-benzyl)thio]-4-methyl-5-(o-tolyl)-1,2,4-triazole Formula: C17H15ClFN3S MolecularWeight: 347.837503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(N2C)SCC3=C(C=CC=C3Cl)F

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(N2C)SCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C17H15ClFN3S/c1-11-6-3-4-7-12(11)16-20-21-17(22(16)2)23-10-13-14(18)8-5-9-15(13)19/h3-9H,10H2,1-2H3