2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-6-ethoxy-1H-benzimidazole

Systemtic Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-6-ethoxy-1H-benzimidazole Openeye Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-6-ethoxy-1H-benzimidazole CAS Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methylthio]-6-ethoxy-1H-benzimidazole IUPAC Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfanyl]-6-ethoxy-1H-benzimidazole Traditional Name: 2-[(4-tert-butyl-2,6-dimethyl-benzyl)thio]-6-ethoxy-1H-benzimidazole Formula: C22H28N2OS MolecularWeight: 368.53552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(N2)SCC3=C(C=C(C=C3C)C(C)(C)C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(N2)SCC3=C(C=C(C=C3C)C(C)(C)C)C

InChI

InChI=1S/C22H28N2OS/c1-7-25-17-8-9-19-20(12-17)24-21(23-19)26-13-18-14(2)10-16(11-15(18)3)22(4,5)6/h8-12H,7,13H2,1-6H3,(H,23,24)