4-cyclohexyl-3-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazole

Systemtic Name: 4-cyclohexyl-3-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazole Openeye Name: 4-cyclohexyl-3-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazole CAS Name: 4-cyclohexyl-3-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-5-(4-methoxyphenyl)-1,2,4-triazole IUPAC Name: 4-cyclohexyl-3-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazole Traditional Name: 4-cyclohexyl-3-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-5-(4-methoxyphenyl)-1,2,4-triazole Formula: C24H26FN3O3S MolecularWeight: 455.544943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2C3CCCCC3)SCC4=C5C(=CC(=C4)F)COCO5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2C3CCCCC3)SCC4=C5C(=CC(=C4)F)COCO5

InChI

InChI=1S/C24H26FN3O3S/c1-29-21-9-7-16(8-10-21)23-26-27-24(28(23)20-5-3-2-4-6-20)32-14-18-12-19(25)11-17-13-30-15-31-22(17)18/h7-12,20H,2-6,13-15H2,1H3