3-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-4-methyl-5-[(2-methylphenoxy)methyl]-1,2,4-triazole

Systemtic Name: 3-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-4-methyl-5-[(2-methylphenoxy)methyl]-1,2,4-triazole Openeye Name: 3-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-4-methyl-5-[(2-methylphenoxy)methyl]-1,2,4-triazole CAS Name: 3-[(4-tert-butyl-2,6-dimethylphenyl)methylthio]-4-methyl-5-[(2-methylphenoxy)methyl]-1,2,4-triazole IUPAC Name: 3-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfanyl]-4-methyl-5-[(2-methylphenoxy)methyl]-1,2,4-triazole Traditional Name: 3-[(4-tert-butyl-2,6-dimethyl-benzyl)thio]-4-methyl-5-[(2-methylphenoxy)methyl]-1,2,4-triazole Formula: C24H31N3OS MolecularWeight: 409.58744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC2=NN=C(N2C)SCC3=C(C=C(C=C3C)C(C)(C)C)C

Isomeric SMILES

CC1=CC=CC=C1OCC2=NN=C(N2C)SCC3=C(C=C(C=C3C)C(C)(C)C)C

InChI

InChI=1S/C24H31N3OS/c1-16-10-8-9-11-21(16)28-14-22-25-26-23(27(22)7)29-15-20-17(2)12-19(13-18(20)3)24(4,5)6/h8-13H,14-15H2,1-7H3