3-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-[(2-chloro-6-fluorophenyl)methylthio]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(2-chloro-6-fluorophenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(2-chloro-6-fluoro-benzyl)thio]-1,2,4-triazole Formula: C12H11ClFN3S MolecularWeight: 283.752243

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C=NN=C1SCC2=C(C=CC=C2Cl)F

Isomeric SMILES

C=CCN1C=NN=C1SCC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C12H11ClFN3S/c1-2-6-17-8-15-16-12(17)18-7-9-10(13)4-3-5-11(9)14/h2-5,8H,1,6-7H2