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

Systemtic Name: 3-[(4-fluorophenyl)methylsulfanylmethyl]-4-[(4-methylphenyl)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(4-fluorophenyl)methylsulfanylmethyl]-4-(p-tolylmethyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[[(4-fluorophenyl)methylthio]methyl]-4-[(4-methylphenyl)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(4-fluorophenyl)methylsulfanylmethyl]-4-[(4-methylphenyl)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 3-[[(4-fluorobenzyl)thio]methyl]-4-(4-methylbenzyl)-1H-1,2,4-triazole-5-thione Formula: C18H18FN3S2 MolecularWeight: 359.484023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=NNC2=S)CSCC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=NNC2=S)CSCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H18FN3S2/c1-13-2-4-14(5-3-13)10-22-17(20-21-18(22)23)12-24-11-15-6-8-16(19)9-7-15/h2-9H,10-12H2,1H3,(H,21,23)