3-[(2-fluorophenyl)methylsulfanyl]-5-(4-methoxyphenyl)-4-phenethyl-1,2,4-triazole

Systemtic Name: 3-[(2-fluorophenyl)methylsulfanyl]-5-(4-methoxyphenyl)-4-phenethyl-1,2,4-triazole Openeye Name: 3-[(2-fluorophenyl)methylsulfanyl]-5-(4-methoxyphenyl)-4-phenethyl-1,2,4-triazole CAS Name: 3-[(2-fluorophenyl)methylthio]-5-(4-methoxyphenyl)-4-phenethyl-1,2,4-triazole IUPAC Name: 3-[(2-fluorophenyl)methylsulfanyl]-5-(4-methoxyphenyl)-4-phenethyl-1,2,4-triazole Traditional Name: 3-[(2-fluorobenzyl)thio]-5-(4-methoxyphenyl)-4-phenethyl-1,2,4-triazole Formula: C24H22FN3OS MolecularWeight: 419.514383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2CCC3=CC=CC=C3)SCC4=CC=CC=C4F

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2CCC3=CC=CC=C3)SCC4=CC=CC=C4F

InChI

InChI=1S/C24H22FN3OS/c1-29-21-13-11-19(12-14-21)23-26-27-24(30-17-20-9-5-6-10-22(20)25)28(23)16-15-18-7-3-2-4-8-18/h2-14H,15-17H2,1H3