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

Systemtic Name: 3-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-5-methyl-1H-1,2,4-triazole Openeye Name: 3-[(2-chloro-4-fluoro-phenyl)methylsulfanyl]-5-methyl-1H-1,2,4-triazole CAS Name: 3-[(2-chloro-4-fluorophenyl)methylthio]-5-methyl-1H-1,2,4-triazole IUPAC Name: 3-[(2-chloro-4-fluorophenyl)methylsulfanyl]-5-methyl-1H-1,2,4-triazole Traditional Name: 3-[(2-chloro-4-fluoro-benzyl)thio]-5-methyl-1H-1,2,4-triazole Formula: C10H9ClFN3S MolecularWeight: 257.714963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)SCC2=C(C=C(C=C2)F)Cl

Isomeric SMILES

CC1=NC(=NN1)SCC2=C(C=C(C=C2)F)Cl

InChI

InChI=1S/C10H9ClFN3S/c1-6-13-10(15-14-6)16-5-7-2-3-8(12)4-9(7)11/h2-4H,5H2,1H3,(H,13,14,15)