3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-allyl-3-[(2-chloro-6-fluoro-phenyl)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-[(2-chloro-6-fluorophenyl)methyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(2-chloro-6-fluorophenyl)methyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-allyl-3-(2-chloro-6-fluoro-benzyl)-1H-1,2,4-triazole-5-thione Formula: C12H11ClFN3S MolecularWeight: 283.752243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NNC1=S)CC2=C(C=CC=C2Cl)F

Isomeric SMILES

C=CCN1C(=NNC1=S)CC2=C(C=CC=C2Cl)F

InChI

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