4-cyclohexyl-3-(furan-2-yl)-5-[2-(2-methoxyphenoxy)ethylsulfanyl]-1,2,4-triazole

Systemtic Name: 4-cyclohexyl-3-(furan-2-yl)-5-[2-(2-methoxyphenoxy)ethylsulfanyl]-1,2,4-triazole Openeye Name: 4-cyclohexyl-3-(2-furyl)-5-[2-(2-methoxyphenoxy)ethylsulfanyl]-1,2,4-triazole CAS Name: 4-cyclohexyl-3-(2-furanyl)-5-[2-(2-methoxyphenoxy)ethylthio]-1,2,4-triazole IUPAC Name: 4-cyclohexyl-3-(furan-2-yl)-5-[2-(2-methoxyphenoxy)ethylsulfanyl]-1,2,4-triazole Traditional Name: 4-cyclohexyl-3-(2-furyl)-5-[2-(2-methoxyphenoxy)ethylthio]-1,2,4-triazole Formula: C21H25N3O3S MolecularWeight: 399.5065

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCCSC2=NN=C(N2C3CCCCC3)C4=CC=CO4

Isomeric SMILES

COC1=CC=CC=C1OCCSC2=NN=C(N2C3CCCCC3)C4=CC=CO4

InChI

InChI=1S/C21H25N3O3S/c1-25-17-10-5-6-11-18(17)27-14-15-28-21-23-22-20(19-12-7-13-26-19)24(21)16-8-3-2-4-9-16/h5-7,10-13,16H,2-4,8-9,14-15H2,1H3