4-cyclohexyl-3-methyl-5-(2-naphthalen-1-yloxyethylsulfanyl)-1,2,4-triazole

Systemtic Name: 4-cyclohexyl-3-methyl-5-(2-naphthalen-1-yloxyethylsulfanyl)-1,2,4-triazole Openeye Name: 4-cyclohexyl-3-methyl-5-[2-(1-naphthyloxy)ethylsulfanyl]-1,2,4-triazole CAS Name: 4-cyclohexyl-3-methyl-5-[2-(1-naphthalenyloxy)ethylthio]-1,2,4-triazole IUPAC Name: 4-cyclohexyl-3-methyl-5-(2-naphthalen-1-yloxyethylsulfanyl)-1,2,4-triazole Traditional Name: 4-cyclohexyl-3-methyl-5-[2-(1-naphthoxy)ethylthio]-1,2,4-triazole Formula: C21H25N3OS MolecularWeight: 367.5077

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CCCCC2)SCCOC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=NN=C(N1C2CCCCC2)SCCOC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H25N3OS/c1-16-22-23-21(24(16)18-10-3-2-4-11-18)26-15-14-25-20-13-7-9-17-8-5-6-12-19(17)20/h5-9,12-13,18H,2-4,10-11,14-15H2,1H3