3-[(4-fluorophenyl)methylsulfanylmethyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(4-fluorophenyl)methylsulfanylmethyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-allyl-3-[(4-fluorophenyl)methylsulfanylmethyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-[[(4-fluorophenyl)methylthio]methyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(4-fluorophenyl)methylsulfanylmethyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-allyl-3-[[(4-fluorobenzyl)thio]methyl]-1H-1,2,4-triazole-5-thione Formula: C13H14FN3S2 MolecularWeight: 295.398763

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NNC1=S)CSCC2=CC=C(C=C2)F

Isomeric SMILES

C=CCN1C(=NNC1=S)CSCC2=CC=C(C=C2)F

InChI

InChI=1S/C13H14FN3S2/c1-2-7-17-12(15-16-13(17)18)9-19-8-10-3-5-11(14)6-4-10/h2-6H,1,7-9H2,(H,16,18)