1-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonyl-2-[(4-methylphenoxy)methyl]benzimidazole

Systemtic Name: 1-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonyl-2-[(4-methylphenoxy)methyl]benzimidazole Openeye Name: 1-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonyl-2-[(4-methylphenoxy)methyl]benzimidazole CAS Name: 1-(4-tert-butyl-2,6-dimethylphenyl)sulfonyl-2-[(4-methylphenoxy)methyl]benzimidazole IUPAC Name: 1-(4-tert-butyl-2,6-dimethylphenyl)sulfonyl-2-[(4-methylphenoxy)methyl]benzimidazole Traditional Name: 1-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonyl-2-[(4-methylphenoxy)methyl]benzimidazole Formula: C27H30N2O3S MolecularWeight: 462.6037

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC2=NC3=CC=CC=C3N2S(=O)(=O)C4=C(C=C(C=C4C)C(C)(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)OCC2=NC3=CC=CC=C3N2S(=O)(=O)C4=C(C=C(C=C4C)C(C)(C)C)C

InChI

InChI=1S/C27H30N2O3S/c1-18-11-13-22(14-12-18)32-17-25-28-23-9-7-8-10-24(23)29(25)33(30,31)26-19(2)15-21(16-20(26)3)27(4,5)6/h7-16H,17H2,1-6H3