4-cyclohexyl-3-methyl-5-[2-(2-methylphenoxy)ethylsulfanyl]-1,2,4-triazole

Systemtic Name: 4-cyclohexyl-3-methyl-5-[2-(2-methylphenoxy)ethylsulfanyl]-1,2,4-triazole Openeye Name: 4-cyclohexyl-3-methyl-5-[2-(2-methylphenoxy)ethylsulfanyl]-1,2,4-triazole CAS Name: 4-cyclohexyl-3-methyl-5-[2-(2-methylphenoxy)ethylthio]-1,2,4-triazole IUPAC Name: 4-cyclohexyl-3-methyl-5-[2-(2-methylphenoxy)ethylsulfanyl]-1,2,4-triazole Traditional Name: 4-cyclohexyl-3-methyl-5-[2-(2-methylphenoxy)ethylthio]-1,2,4-triazole Formula: C18H25N3OS MolecularWeight: 331.4756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCSC2=NN=C(N2C3CCCCC3)C

Isomeric SMILES

CC1=CC=CC=C1OCCSC2=NN=C(N2C3CCCCC3)C

InChI

InChI=1S/C18H25N3OS/c1-14-8-6-7-11-17(14)22-12-13-23-18-20-19-15(2)21(18)16-9-4-3-5-10-16/h6-8,11,16H,3-5,9-10,12-13H2,1-2H3