N-[[4-ethyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-4-fluoranyl-aniline

Systemtic Name: N-[[4-ethyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-4-fluoranyl-aniline Openeye Name: N-[[4-ethyl-5-(p-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-4-fluoro-aniline CAS Name: N-[[4-ethyl-5-[(4-methylphenyl)methylthio]-1,2,4-triazol-3-yl]methyl]-4-fluoroaniline IUPAC Name: N-[[4-ethyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-4-fluoroaniline Traditional Name: [4-ethyl-5-[(4-methylbenzyl)thio]-1,2,4-triazol-3-yl]methyl-(4-fluorophenyl)amine Formula: C19H21FN4S MolecularWeight: 356.460243

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=C(C=C2)C)CNC3=CC=C(C=C3)F

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=C(C=C2)C)CNC3=CC=C(C=C3)F

InChI

InChI=1S/C19H21FN4S/c1-3-24-18(12-21-17-10-8-16(20)9-11-17)22-23-19(24)25-13-15-6-4-14(2)5-7-15/h4-11,21H,3,12-13H2,1-2H3