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

Systemtic Name: 3-(4-chlorophenyl)-5-[(3-fluorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazole Openeye Name: 3-(4-chlorophenyl)-5-[(3-fluorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazole CAS Name: 3-(4-chlorophenyl)-5-[(3-fluorophenyl)methylthio]-4-methyl-1,2,4-triazole IUPAC Name: 3-(4-chlorophenyl)-5-[(3-fluorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazole Traditional Name: 3-(4-chlorophenyl)-5-[(3-fluorobenzyl)thio]-4-methyl-1,2,4-triazole Formula: C16H13ClFN3S MolecularWeight: 333.810923

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC(=CC=C2)F)C3=CC=C(C=C3)Cl

Isomeric SMILES

CN1C(=NN=C1SCC2=CC(=CC=C2)F)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClFN3S/c1-21-15(12-5-7-13(17)8-6-12)19-20-16(21)22-10-11-3-2-4-14(18)9-11/h2-9H,10H2,1H3