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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(N2C)SCC3=CC=CC=C3F)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(N2C)SCC3=CC=CC=C3F)Cl

InChI

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