4-cyclohexyl-3-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-5-(2-methoxyphenyl)-1,2,4-triazole

Systemtic Name: 4-cyclohexyl-3-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-5-(2-methoxyphenyl)-1,2,4-triazole Openeye Name: 4-cyclohexyl-3-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-5-(2-methoxyphenyl)-1,2,4-triazole CAS Name: 4-cyclohexyl-3-[(3-fluoro-4-methoxyphenyl)methylthio]-5-(2-methoxyphenyl)-1,2,4-triazole IUPAC Name: 4-cyclohexyl-3-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-5-(2-methoxyphenyl)-1,2,4-triazole Traditional Name: 4-cyclohexyl-3-[(3-fluoro-4-methoxy-benzyl)thio]-5-(2-methoxyphenyl)-1,2,4-triazole Formula: C23H26FN3O2S MolecularWeight: 427.534843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=NN=C(N2C3CCCCC3)C4=CC=CC=C4OC)F

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=NN=C(N2C3CCCCC3)C4=CC=CC=C4OC)F

InChI

InChI=1S/C23H26FN3O2S/c1-28-20-11-7-6-10-18(20)22-25-26-23(27(22)17-8-4-3-5-9-17)30-15-16-12-13-21(29-2)19(24)14-16/h6-7,10-14,17H,3-5,8-9,15H2,1-2H3