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

Systemtic Name: 4-cyclohexyl-3-[(2-fluorophenyl)methylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazole Openeye Name: 4-cyclohexyl-3-[(2-fluorophenyl)methylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazole CAS Name: 4-cyclohexyl-3-[(2-fluorophenyl)methylthio]-5-(4-methoxyphenyl)-1,2,4-triazole IUPAC Name: 4-cyclohexyl-3-[(2-fluorophenyl)methylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazole Traditional Name: 4-cyclohexyl-3-[(2-fluorobenzyl)thio]-5-(4-methoxyphenyl)-1,2,4-triazole Formula: C22H24FN3OS MolecularWeight: 397.508863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2C3CCCCC3)SCC4=CC=CC=C4F

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2C3CCCCC3)SCC4=CC=CC=C4F

InChI

InChI=1S/C22H24FN3OS/c1-27-19-13-11-16(12-14-19)21-24-25-22(26(21)18-8-3-2-4-9-18)28-15-17-7-5-6-10-20(17)23/h5-7,10-14,18H,2-4,8-9,15H2,1H3