3-[(4-fluorophenyl)methylsulfanyl]-N-[(4-methylphenyl)methyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-[(4-fluorophenyl)methylsulfanyl]-N-[(4-methylphenyl)methyl]-1,2,4-triazol-4-amine Openeye Name: 3-[(4-fluorophenyl)methylsulfanyl]-N-(p-tolylmethyl)-1,2,4-triazol-4-amine CAS Name: 3-[(4-fluorophenyl)methylthio]-N-[(4-methylphenyl)methyl]-1,2,4-triazol-4-amine IUPAC Name: 3-[(4-fluorophenyl)methylsulfanyl]-N-[(4-methylphenyl)methyl]-1,2,4-triazol-4-amine Traditional Name: [3-[(4-fluorobenzyl)thio]-1,2,4-triazol-4-yl]-(4-methylbenzyl)amine Formula: C17H17FN4S MolecularWeight: 328.407083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNN2C=NN=C2SCC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)CNN2C=NN=C2SCC3=CC=C(C=C3)F

InChI

InChI=1S/C17H17FN4S/c1-13-2-4-14(5-3-13)10-20-22-12-19-21-17(22)23-11-15-6-8-16(18)9-7-15/h2-9,12,20H,10-11H2,1H3