3-cyclohexyl-5-[2-(5-methyl-2-propan-2-yl-phenoxy)ethylsulfanyl]-4-phenyl-1,2,4-triazole

Systemtic Name: 3-cyclohexyl-5-[2-(5-methyl-2-propan-2-yl-phenoxy)ethylsulfanyl]-4-phenyl-1,2,4-triazole Openeye Name: 3-cyclohexyl-5-[2-(2-isopropyl-5-methyl-phenoxy)ethylsulfanyl]-4-phenyl-1,2,4-triazole CAS Name: 3-cyclohexyl-5-[2-(5-methyl-2-propan-2-ylphenoxy)ethylthio]-4-phenyl-1,2,4-triazole IUPAC Name: 3-cyclohexyl-5-[2-(5-methyl-2-propan-2-ylphenoxy)ethylsulfanyl]-4-phenyl-1,2,4-triazole Traditional Name: 3-cyclohexyl-5-[2-(2-isopropyl-5-methyl-phenoxy)ethylthio]-4-phenyl-1,2,4-triazole Formula: C26H33N3OS MolecularWeight: 435.62472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCCSC2=NN=C(N2C3=CC=CC=C3)C4CCCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCCSC2=NN=C(N2C3=CC=CC=C3)C4CCCCC4

InChI

InChI=1S/C26H33N3OS/c1-19(2)23-15-14-20(3)18-24(23)30-16-17-31-26-28-27-25(21-10-6-4-7-11-21)29(26)22-12-8-5-9-13-22/h5,8-9,12-15,18-19,21H,4,6-7,10-11,16-17H2,1-3H3