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

Systemtic Name: 4-cyclohexyl-3-[(3-fluorophenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,2,4-triazole Openeye Name: 4-cyclohexyl-3-[(3-fluorophenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,2,4-triazole CAS Name: 4-cyclohexyl-3-[(3-fluorophenyl)methylthio]-5-[(4-methoxyphenyl)methyl]-1,2,4-triazole IUPAC Name: 4-cyclohexyl-3-[(3-fluorophenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,2,4-triazole Traditional Name: 4-cyclohexyl-3-[(3-fluorobenzyl)thio]-5-p-anisyl-1,2,4-triazole Formula: C23H26FN3OS MolecularWeight: 411.535443

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NN=C(N2C3CCCCC3)SCC4=CC(=CC=C4)F

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NN=C(N2C3CCCCC3)SCC4=CC(=CC=C4)F

InChI

InChI=1S/C23H26FN3OS/c1-28-21-12-10-17(11-13-21)15-22-25-26-23(27(22)20-8-3-2-4-9-20)29-16-18-6-5-7-19(24)14-18/h5-7,10-14,20H,2-4,8-9,15-16H2,1H3