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

Systemtic Name: 5-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-1-(2-methoxy-5-methyl-phenyl)-1,2,3,4-tetrazole Openeye Name: 5-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-1-(2-methoxy-5-methyl-phenyl)tetrazole CAS Name: 5-[(4-tert-butyl-2,6-dimethylphenyl)methylthio]-1-(2-methoxy-5-methylphenyl)tetrazole IUPAC Name: 5-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfanyl]-1-(2-methoxy-5-methylphenyl)tetrazole Traditional Name: 5-[(4-tert-butyl-2,6-dimethyl-benzyl)thio]-1-(2-methoxy-5-methyl-phenyl)tetrazole Formula: C22H28N4OS MolecularWeight: 396.54892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N2C(=NN=N2)SCC3=C(C=C(C=C3C)C(C)(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N2C(=NN=N2)SCC3=C(C=C(C=C3C)C(C)(C)C)C

InChI

InChI=1S/C22H28N4OS/c1-14-8-9-20(27-7)19(10-14)26-21(23-24-25-26)28-13-18-15(2)11-17(12-16(18)3)22(4,5)6/h8-12H,13H2,1-7H3